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dodecyl benzoate

Flow Object IDfo-509b72e05afa9b1d
TypeConsensus
prefLabel
Label Language
dodecyl benzoate en
Alt Labels
Label Language Provenance
Benzoic acid, C<sub>12-15</sub>-alkyl esters en —
CAS Numbers68411-27-8
EC Numbers270-112-4
Changes Applied52

Properties

Predicate Value
InChIKey DLAHAXOYRFRPFQ-UHFFFAOYSA-N, QEWJMCDXPTUEBT-UHFFFAOYSA-M
InChI InChI=1S/C19H30O2/c1-2-3-4-5-6-7-8-9-10-14-17-21-19(20)18-15-12-11-13-16-18/h11-13,15-16H,2-10,14,17H2,1H3, InChI=1S/C39H41N3O6S2.Na/c1-4-40-34-17-15-33(16-18-34)38-23-14-32(26-39(38)50(46,47)48)28-42(6-3)36-21-12-30(13-22-36)24-29-10-19-35(20-11-29)41(5-2)27-31-8-7-9-37(25-31)49(43,44)45;/h7-26,40H,4-6,27-28H2,1-3H3,(H-,43,44,45,46,47,48);/q;+1/p-1
IUPAC name benzoic acid dodecyl ester, benzoic acid lauryl ester, dodecyl benzoate, sodium 2-[4-(ethylamino)phenyl]-5-[[N-ethyl-4-[[4-[ethyl-(3-sulfonatobenzyl)iminio]cyclohexa-2,5-dien-1-ylidene]methyl]anilino]methyl]besylate, sodium 2-[4-(ethylamino)phenyl]-5-[[N-ethyl-4-[[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]anilino]methyl]benzenesulfonate, sodium 2-[4-(ethylamino)phenyl]-5-[[N-ethyl-4-[[4-[ethyl-[(3-sulfonatophenyl)methyl]iminio]-1-cyclohexa-2,5-dienylidene]methyl]anilino]methyl]benzenesulfonate, sodium 2-[4-(ethylamino)phenyl]-5-[[N-ethyl-4-[[4-[ethyl-[(3-sulfonatophenyl)methyl]iminio]cyclohexa-2,5-dien-1-ylidene]methyl]anilino]methyl]benzenesulfonate, sodium 2-[4-(ethylamino)phenyl]-5-[[ethyl-[4-[[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]phenyl]amino]methyl]benzenesulfonate
Molecular formula C19H30O2, C39H40N3NaO6S2
SMILES CCCCCCCCCCCCOC(=O)C1=CC=CC=C1, CCNC1=CC=C(C=C1)C2=C(C=C(C=C2)CN(CC)C3=CC=C(C=C3)C=C4C=CC(=[N+](CC)CC5=CC(=CC=C5)S(=O)(=O)[O-])C=C4)S(=O)(=O)[O-].[Na+]

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
7026102c… EF 3.1 kg Environmental → Air → Aircraft cruise height 4 4
9b1a8f7e… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 4
e6ad901f… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 4 4
9ec75758… EF 3.1 kg Environmental → Air → High stack, >150 meters 4 4
5852f0a4… EF 3.1 kg Environmental → Air → Unknown 4 4
8fb25329… EF 3.1 kg Environmental → Air → Unknown 4 4
5033a833… EF 3.1 kg Environmental → Ground → Agricultural 4 4
8157e027… EF 3.1 kg Environmental → Ground → Unknown 4 4
52889e2e… EF 3.1 kg Environmental → Water → Ocean 4 4
4c492d27… EF 3.1 kg Environmental → Water → Surface water 4 4
6251e109… EF 3.1 kg Environmental → Water → Unknown 4 4
▶

Changes Applied
Elementary Flow Field Old Value New Value Comment
4c492d27… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
4c492d27… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
4c492d27… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
4c492d27… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
5033a833… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
5033a833… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
5033a833… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
5033a833… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
52889e2e… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
52889e2e… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
52889e2e… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
52889e2e… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
5852f0a4… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
5852f0a4… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
5852f0a4… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
5852f0a4… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
6251e109… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
6251e109… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
6251e109… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
6251e109… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
63527cd3… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
63527cd3… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
63527cd3… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
63527cd3… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
7026102c… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
7026102c… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
7026102c… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
7026102c… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
8157e027… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
8157e027… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
8157e027… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
8157e027… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
8c03e221… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
8c03e221… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
8c03e221… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
8c03e221… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
8fb25329… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
8fb25329… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
8fb25329… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
8fb25329… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
9b1a8f7e… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
9b1a8f7e… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
9b1a8f7e… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
9b1a8f7e… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
9ec75758… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
9ec75758… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
9ec75758… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
9ec75758… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}
e6ad901f… prefLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"legacy name field"}}] [{"@value":"dodecyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","name:dodecyl benzoate","https://pubchem.ncbi.nlm.nih.gov/compound/76204"],"prov:wasDerivedFrom":"pubchem preferred label selection"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=4.0323; pubchem_entropy=3.3232; current_score=4.3023; pubchem_score=3.4732; score_improvement=0.8291; threshold=0.400; min_margin=0.400; object_uuid=fo-509b72e05afa9b1d
e6ad901f… altLabel — [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added current EF name as altLabel when prefLabel differs; object_uuid=fo-509b72e05afa9b1d
e6ad901f… altLabel [{"@value":"Benzoic Acid, C12-15-alkyl Esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1"],"prov:wasDerivedFrom":"original EF name retained as altLabel"}}] [{"@value":"Benzoic acid, C<sub>12-15</sub>-alkyl esters","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68411-27-8","https://commonchemistry.cas.org/detail?cas_rn=68411-27-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; cas=68411-27-8; added Common Chemistry CAS names as altLabel: Benzoic acid, C<sub>12-15</sub>-alkyl esters; object_uuid=fo-509b72e05afa9b1d
e6ad901f… cas_match_labels — {"68411-27-8":"exactMatch"} group_key=benzoicacid,c12-15-alkylesters||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'68411-27-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-509b72e05afa9b1d: {'68411-27-8': 'exactMatch'}

Flow Object JSON

{
  "flow_object_id": "fo-509b72e05afa9b1d",
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      "@value": "dodecyl benzoate",
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  "altLabel": [
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  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C19H30O2",
        "C39H40N3NaO6S2"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
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    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "DLAHAXOYRFRPFQ-UHFFFAOYSA-N",
        "QEWJMCDXPTUEBT-UHFFFAOYSA-M"
      ],
      "rdfs:label": "InChIKey",
      "provenance": {
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    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "CCCCCCCCCCCCOC(=O)C1=CC=CC=C1",
        "CCNC1=CC=C(C=C1)C2=C(C=C(C=C2)CN(CC)C3=CC=C(C=C3)C=C4C=CC(=[N+](CC)CC5=CC(=CC=C5)S(=O)(=O)[O-])C=C4)S(=O)(=O)[O-].[Na+]"
      ],
      "rdfs:label": "SMILES",
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C19H30O2/c1-2-3-4-5-6-7-8-9-10-14-17-21-19(20)18-15-12-11-13-16-18/h11-13,15-16H,2-10,14,17H2,1H3",
        "InChI=1S/C39H41N3O6S2.Na/c1-4-40-34-17-15-33(16-18-34)38-23-14-32(26-39(38)50(46,47)48)28-42(6-3)36-21-12-30(13-22-36)24-29-10-19-35(20-11-29)41(5-2)27-31-8-7-9-37(25-31)49(43,44)45;/h7-26,40H,4-6,27-28H2,1-3H3,(H-,43,44,45,46,47,48);/q;+1/p-1"
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        "prov:wasDerivedFrom": "pubchem.props.InChI"
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    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "benzoic acid dodecyl ester",
        "benzoic acid lauryl ester",
        "dodecyl benzoate",
        "sodium 2-[4-(ethylamino)phenyl]-5-[[N-ethyl-4-[[4-[ethyl-(3-sulfonatobenzyl)iminio]cyclohexa-2,5-dien-1-ylidene]methyl]anilino]methyl]besylate",
        "sodium 2-[4-(ethylamino)phenyl]-5-[[N-ethyl-4-[[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]anilino]methyl]benzenesulfonate",
        "sodium 2-[4-(ethylamino)phenyl]-5-[[N-ethyl-4-[[4-[ethyl-[(3-sulfonatophenyl)methyl]iminio]-1-cyclohexa-2,5-dienylidene]methyl]anilino]methyl]benzenesulfonate",
        "sodium 2-[4-(ethylamino)phenyl]-5-[[N-ethyl-4-[[4-[ethyl-[(3-sulfonatophenyl)methyl]iminio]cyclohexa-2,5-dien-1-ylidene]methyl]anilino]methyl]benzenesulfonate",
        "sodium 2-[4-(ethylamino)phenyl]-5-[[ethyl-[4-[[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]phenyl]amino]methyl]benzenesulfonate"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
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          "CID:105711"
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        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J306.841B",
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    {
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    {
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