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Pinane

UUID fa9405be-5d9d-4430-b366-4b9b3adbff90
Deprecated yes
Replaced By a9c086bd-080f-4a14-8aa9-9a298f43d810
Flow Object IDfo-3d23da947b4557e6
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 473-55-2
EC Numbers 207-467-1
prefLabel ⓘ
Language Value Provenance
en Pinane
altLabel ⓘ
Language Value Provenance
en dihydropinene
en 2,6,6-Trimethylbicyclo[3.1.1]heptane
en Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-
en NSC 76674
Definitions
Language Value Provenance
en A monoterpene that is bicyclo[3.1.1]heptane substituted by methyl groups at positions 2, 6 and 6.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey XOKSLPVRUOBDEW-UHFFFAOYSA-N
InChI InChI=1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3
IUPAC name 2,6,6-trimethylbicyclo[3.1.1]heptane, 2,6,6-trimethylnorpinane
Molecular formula C10H18
Molecular mass 138.254
Monoisotopic mass 138.14085
SMILES CC1CCC2CC1C2(C)C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 fa9405be-5d9d-4430-b366-4b9b3adbff90 2,6,6-trimethylbicyclo[3.1.1]heptane

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=2,6,6-trimethylbicyclo[3.1.1]heptane||dimension=Environmental > media=Water > water_body=Unknown; cas=473-55-2; added Common Chemistry CAS names as altLabel: 2,6,6-Trimethylbicyclo[3.1.1]heptane, Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-, NSC 76674; object_uuid=fo-3d23da947b4557e6
cas_match_labels 1 — consensus_match group_key=2,6,6-trimethylbicyclo[3.1.1]heptane||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory']; cas_sources={'473-55-2': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-3d23da947b4557e6: {'473-55-2': 'exactMatch'}
prefLabel 1 — consensus_match cas=473-55-2; cc_chebi_agreed_name='Pinane'; object_uuid=fo-3d23da947b4557e6

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': '2,6,6-trimethylbicyclo[3.1.1]heptane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': 'Pinane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:473-55-2'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=473-55-2; cc_chebi_agreed_name='Pinane'; object_uuid=fo-3d23da947b4557e6
altLabel [{'@value': 'dihydropinene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:dihydropinene', 'http://purl.obolibrary.org/obo/CHEBI_35710', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'pinane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:pinane', 'http://purl.obolibrary.org/obo/CHEBI_35710', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': 'dihydropinene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:dihydropinene', 'http://purl.obolibrary.org/obo/CHEBI_35710', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,6,6-trimethylbicyclo[3.1.1]heptane', '@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=473-55-2; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-3d23da947b4557e6
altLabel [{'@value': 'dihydropinene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:dihydropinene', 'http://purl.obolibrary.org/obo/CHEBI_35710', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,6,6-trimethylbicyclo[3.1.1]heptane', '@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': 'dihydropinene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:dihydropinene', 'http://purl.obolibrary.org/obo/CHEBI_35710', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,6,6-Trimethylbicyclo[3.1.1]heptane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:473-55-2', 'https://commonchemistry.cas.org/detail?cas_rn=473-55-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:473-55-2', 'https://commonchemistry.cas.org/detail?cas_rn=473-55-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 76674', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:473-55-2', 'https://commonchemistry.cas.org/detail?cas_rn=473-55-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=2,6,6-trimethylbicyclo[3.1.1]heptane||dimension=Environmental > media=Water > water_body=Unknown; cas=473-55-2; added Common Chemistry CAS names as altLabel: 2,6,6-Trimethylbicyclo[3.1.1]heptane, Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-, NSC 76674; object_uuid=fo-3d23da947b4557e6
cas_match_labels None {'473-55-2': 'exactMatch'} group_key=2,6,6-trimethylbicyclo[3.1.1]heptane||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory']; cas_sources={'473-55-2': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-3d23da947b4557e6: {'473-55-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "unit": "kg",
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