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2,2,4-Trimethyl-1,3-pentanediol

UUID d8cc8153-0336-43f0-b3b2-1015ff503232
Flow Object IDfo-f5f925cf66b1eea7
Source EF 3.1
Context Environmental → Air → Aircraft cruise height
CAS Numbers 144-19-4
EC Numbers 205-619-1
prefLabel ⓘ
Language Value Provenance
en 2,2,4-Trimethyl-1,3-pentanediol
altLabel ⓘ
Language Value Provenance
en 1,3-Pentanediol, 2,2,4-trimethyl-
en 2,2,4-Trimethylpentan-1,3-diol
en NSC 6368
en Nexcoat 795
en TMPD (alcohol)
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey JCTXKRPTIMZBJT-UHFFFAOYSA-N
InChI InChI=1S/C8H18O2/c1-6(2)7(10)8(3,4)5-9/h6-7,9-10H,5H2,1-4H3
IUPAC name 2,2,4-trimethylpentane-1,3-diol
Molecular formula C8H18O2
Molecular mass 146.23
Monoisotopic mass 146.13068
SMILES CC(C)C(C(C)(C)CO)O, CC(C)C(O)C(C)(C)CO

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 d8cc8153-0336-43f0-b3b2-1015ff503232 2,2,4-trimethylpentane-1,3-diol

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 2,2,4-trimethylpentane-1,3-diol Emissions/Emissions to air/Emissions to lower stratosphere and upper troposphere kg exactMatch —

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 2 — consensus_match group_key=2,2,4-trimethylpentane-1,3-diol||dimension=Environmental > media=Ground > geography=Unknown; cas=144-19-4; added Common Chemistry CAS names as altLabel: 1,3-Pentanediol, 2,2,4-trimethyl-, 2,2,4-Trimethylpentan-1,3-diol, NSC 6368, Nexcoat 795, TMPD (alcohol); object_uuid=fo-f5f925cf66b1eea7
cas_match_labels 1 — consensus_match group_key=2,2,4-trimethylpentane-1,3-diol||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'144-19-4': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f5f925cf66b1eea7: {'144-19-4': 'exactMatch'}
prefLabel 1 — consensus_match cas=144-19-4; cc_chebi_agreed_name='2,2,4-Trimethyl-1,3-pentanediol'; object_uuid=fo-f5f925cf66b1eea7

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataAircraft cruise height

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': '2,2,4-trimethylpentane-1,3-diol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': '2,2,4-Trimethyl-1,3-pentanediol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:144-19-4'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=144-19-4; cc_chebi_agreed_name='2,2,4-Trimethyl-1,3-pentanediol'; object_uuid=fo-f5f925cf66b1eea7
altLabel None [{'@value': '2,2,4-trimethylpentane-1,3-diol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] cas=144-19-4; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-f5f925cf66b1eea7
altLabel [{'@value': '2,2,4-trimethylpentane-1,3-diol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] [{'@value': '1,3-Pentanediol, 2,2,4-trimethyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:144-19-4', 'https://commonchemistry.cas.org/detail?cas_rn=144-19-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,2,4-Trimethylpentan-1,3-diol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:144-19-4', 'https://commonchemistry.cas.org/detail?cas_rn=144-19-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 6368', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:144-19-4', 'https://commonchemistry.cas.org/detail?cas_rn=144-19-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Nexcoat 795', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:144-19-4', 'https://commonchemistry.cas.org/detail?cas_rn=144-19-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'TMPD (alcohol)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:144-19-4', 'https://commonchemistry.cas.org/detail?cas_rn=144-19-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=2,2,4-trimethylpentane-1,3-diol||dimension=Environmental > media=Ground > geography=Unknown; cas=144-19-4; added Common Chemistry CAS names as altLabel: 1,3-Pentanediol, 2,2,4-trimethyl-, 2,2,4-Trimethylpentan-1,3-diol, NSC 6368, Nexcoat 795, TMPD (alcohol); object_uuid=fo-f5f925cf66b1eea7
cas_match_labels None {'144-19-4': 'exactMatch'} group_key=2,2,4-trimethylpentane-1,3-diol||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'144-19-4': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f5f925cf66b1eea7: {'144-19-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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