← Back to consensus flow objects

3,5,5-trimethylhexanoyl Chloride

Flow Object IDfo-a7b015a47e338b60
TypeConsensus
prefLabel
Label Language
3,5,5-trimethylhexanoyl Chloride en
Alt Labels
Label Language Provenance
2,4,4-Trimethylhexanoyl chloride en
3,5,5-Trimethylhexanoic acid chloride en
Hexanoyl chloride, 3,5,5-trimethyl- en
Isononanoic acid chloride en
CAS Numbers36727-29-4
EC Numbers253-168-4
Changes Applied26

Properties

Predicate Value
InChIKey GEKPNPPFAYJZRD-UHFFFAOYSA-N, GXIQQLXFFZDGHO-UHFFFAOYSA-N, NHEKBXPLFJSSBZ-UHFFFAOYSA-N
InChI InChI=1S/C6H6F8O2/c7-3(8,1-15)5(11,12)6(13,14)4(9,10)2-16/h15-16H,1-2H2, InChI=1S/C9H17ClO/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3, InChI=1S/C9H17ClO/c1-8(2)6-4-3-5-7-9(10)11/h8H,3-7H2,1-2H3
IUPAC name 2,2,3,3,4,4,5,5-octafluorohexane-1,6-diol, 2,2,3,3,4,4,5,5-octakis(fluoranyl)hexane-1,6-diol, 3,5,5-trimethylhexanoyl chloride, 7-methylcaprylyl chloride, 7-methyloctanoyl chloride
Molecular formula C6H6F8O2, C9H17ClO
SMILES C(C(C(C(C(CO)(F)F)(F)F)(F)F)(F)F)O, CC(C)CCCCCC(=O)Cl, CC(CC(=O)Cl)CC(C)(C)C

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
42cea4f9… EF 3.1 kg Environmental → Air → Aircraft cruise height 2 2
0f32897d… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 2
fdf5e6fa… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 2 2
34689ee3… EF 3.1 kg Environmental → Air → High stack, >150 meters 2 2
361a6a7f… EF 3.1 kg Environmental → Air → Unknown 2 2
85737036… EF 3.1 kg Environmental → Air → Unknown 2 2
671aba1e… EF 3.1 kg Environmental → Ground → Agricultural 2 2
1115d462… EF 3.1 kg Environmental → Ground → Unknown 2 2
a1a7203a… EF 3.1 kg Environmental → Water → Ocean 2 2
eeaf14e4… EF 3.1 kg Environmental → Water → Surface water 2 2
bed8d516… EF 3.1 kg Environmental → Water → Unknown 2 2

Changes Applied

Elementary Flow Field Old Value New Value Comment
0f32897d… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
0f32897d… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
1115d462… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
1115d462… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
34689ee3… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
34689ee3… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
361a6a7f… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
361a6a7f… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
42cea4f9… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
42cea4f9… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
671aba1e… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
671aba1e… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
85737036… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
85737036… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
a1a7203a… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
a1a7203a… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
bed8d516… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
bed8d516… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
d93f974d… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
d93f974d… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
db28adff… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
db28adff… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
eeaf14e4… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
eeaf14e4… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}
fdf5e6fa… altLabel [{"@value":"2,4,4-Trimethylhexanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"3,5,5-Trimethylhexanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Hexanoyl chloride, 3,5,5-trimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Isononanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:36727-29-4","https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=36727-29-4; added Common Chemistry CAS names as altLabel: 2,4,4-Trimethylhexanoyl chloride, 3,5,5-Trimethylhexanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, Isononanoic acid chloride; object_uuid=fo-a7b015a47e338b60
fdf5e6fa… cas_match_labels {"36727-29-4":"exactMatch"} group_key=3,5,5-trimethylhexanoylchloride||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'36727-29-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7b015a47e338b60: {'36727-29-4': 'exactMatch'}

Flow Object JSON

{
  "flow_object_id": "fo-a7b015a47e338b60",
  "prefLabel": [
    {
      "@value": "3,5,5-trimethylhexanoyl Chloride",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "prefLabel"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2,4,4-Trimethylhexanoyl chloride",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "3,5,5-Trimethylhexanoic acid chloride",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "Hexanoyl chloride, 3,5,5-trimethyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "Isononanoic acid chloride",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C6H6F8O2",
        "C9H17ClO"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92654",
          "CID:136181",
          "CID:161929"
        ],
        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "GEKPNPPFAYJZRD-UHFFFAOYSA-N",
        "GXIQQLXFFZDGHO-UHFFFAOYSA-N",
        "NHEKBXPLFJSSBZ-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92654",
          "CID:136181",
          "CID:161929"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "C(C(C(C(C(CO)(F)F)(F)F)(F)F)(F)F)O",
        "CC(C)CCCCCC(=O)Cl",
        "CC(CC(=O)Cl)CC(C)(C)C"
      ],
      "rdfs:label": "SMILES",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92654",
          "CID:136181",
          "CID:161929"
        ],
        "prov:wasDerivedFrom": "pubchem.props.SMILES"
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C6H6F8O2/c7-3(8,1-15)5(11,12)6(13,14)4(9,10)2-16/h15-16H,1-2H2",
        "InChI=1S/C9H17ClO/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3",
        "InChI=1S/C9H17ClO/c1-8(2)6-4-3-5-7-9(10)11/h8H,3-7H2,1-2H3"
      ],
      "rdfs:label": "InChI",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92654",
          "CID:136181",
          "CID:161929"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChI"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "2,2,3,3,4,4,5,5-octafluorohexane-1,6-diol",
        "2,2,3,3,4,4,5,5-octakis(fluoranyl)hexane-1,6-diol",
        "3,5,5-trimethylhexanoyl chloride",
        "7-methylcaprylyl chloride",
        "7-methyloctanoyl chloride"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92654",
          "CID:136181",
          "CID:161929"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J208.996C",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:161929;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J740.987G",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:136181;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.048.319",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:161929;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.055.030",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92654;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.196.075",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:136181;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=355-74-8",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:136181;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=36727-29-4",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "36727-29-4"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID0049284",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:161929;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID60188999",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:136181;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/A39U4JZZ23",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92654;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/Z2J193VP5M",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:161929;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/136181",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:136181;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[36727-29-4]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/161929",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:161929;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[36727-29-4]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/92654",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92654;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[36727-29-4]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3188000",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:161929;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27294911",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:161929;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q81985520",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:136181;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q82001999",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92654;CAS:36727-29-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[36727-29-4]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "0f32897d-4c93-446b-975d-e5ec33cc864d",
    "seed_source": "EF 3.1"
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "36727-29-4"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"
      ],
      "skos:exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=36727-29-4"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "253-168-4"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=253-168-4"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null
}