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5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-2,4,6,6-tetramethyl-5,6,7,7a-tetrahydro-1,3-benzodioxol-5-ol

UUID 959edfca-deab-49c8-a48b-5edbc335c56a
Flow Object IDfo-a4487acd23c12096
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 162691-59-0
EC Numbers 605-301-6
prefLabel
Language Value Provenance
en 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-2,4,6,6-tetramethyl-5,6,7,7a-tetrahydro-1,3-benzodioxol-5-ol
altLabel ⓘ
Language Value Provenance
en 1,3-Benzodioxol-5-ol, 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-yn-1-yl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-
en 1,3-Benzodioxol-5-ol, 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-
en 5-[3-(1-Ethoxyethoxy)-3-methyl-4-penten-1-yn-1-yl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-1,3-benzodioxol-5-ol
References
Shared Properties
Predicate Value
InChIKey RZEIWRMMULENKX-UHFFFAOYSA-N
InChI InChI=1S/C21H32O5/c1-9-20(8,26-15(4)23-10-2)11-12-21(22)14(3)18-17(13-19(21,6)7)24-16(5)25-18/h9,15-17,22H,1,10,13H2,2-8H3
IUPAC name 5-[3-(1-ethoxyethoxy)-3-methyl-pent-4-en-1-ynyl]-2,4,6,6-tetramethyl-7,7a-dihydro-1,3-benzodioxol-5-ol, 5-[3-(1-ethoxyethoxy)-3-methylpent-4-en-1-ynyl]-2,4,6,6-tetramethyl-7,7a-dihydro-1,3-benzodioxol-5-ol
Molecular formula C21H32O5
SMILES CCOC(C)OC(C)(C=C)C#CC1(C(=C2C(CC1(C)C)OC(O2)C)C)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 959edfca-deab-49c8-a48b-5edbc335c56a 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-2,4,6,6-tetramethyl-5,6,7,7a-tetrahydro-1,3-benzodioxol-5-ol

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-2,4,6,6-tetramethyl-5,6,7,7a-tetrahydro-1,3-benzodioxol-5-ol Emissions/Emissions to water/Emissions to water, unspecified kg exactMatch —

Consolidated Field Provenance

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

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-2,4,6,6-tetramethyl-5,6,7,7a-tetrahydro-1,3-benzodioxol-5-ol||dimension=Environmental > media=Ground > geography=Unknown; cas=162691-59-0; added Common Chemistry CAS names as altLabel: 1,3-Benzodioxol-5-ol, 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-yn-1-yl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-, 1,3-Benzodioxol-5-ol, 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-, 5-[3-(1-Ethoxyethoxy)-3-methyl-4-penten-1-yn-1-yl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-1,3-benzodioxol-5-ol; object_uuid=fo-a4487acd23c12096
cas_match_labels 1 — consensus_match group_key=5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-2,4,6,6-tetramethyl-5,6,7,7a-tetrahydro-1,3-benzodioxol-5-ol||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['pubchem']; cas_sources={'162691-59-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a4487acd23c12096: {'162691-59-0': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '1,3-Benzodioxol-5-ol, 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-yn-1-yl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:162691-59-0', 'https://commonchemistry.cas.org/detail?cas_rn=162691-59-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,3-Benzodioxol-5-ol, 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:162691-59-0', 'https://commonchemistry.cas.org/detail?cas_rn=162691-59-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '5-[3-(1-Ethoxyethoxy)-3-methyl-4-penten-1-yn-1-yl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-1,3-benzodioxol-5-ol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:162691-59-0', 'https://commonchemistry.cas.org/detail?cas_rn=162691-59-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-2,4,6,6-tetramethyl-5,6,7,7a-tetrahydro-1,3-benzodioxol-5-ol||dimension=Environmental > media=Ground > geography=Unknown; cas=162691-59-0; added Common Chemistry CAS names as altLabel: 1,3-Benzodioxol-5-ol, 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-yn-1-yl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-, 1,3-Benzodioxol-5-ol, 5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-, 5-[3-(1-Ethoxyethoxy)-3-methyl-4-penten-1-yn-1-yl]-5,6,7,7a-tetrahydro-2,4,6,6-tetramethyl-1,3-benzodioxol-5-ol; object_uuid=fo-a4487acd23c12096
cas_match_labels None {'162691-59-0': 'exactMatch'} group_key=5-[3-(1-ethoxyethoxy)-3-methyl-4-penten-1-ynyl]-2,4,6,6-tetramethyl-5,6,7,7a-tetrahydro-1,3-benzodioxol-5-ol||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['pubchem']; cas_sources={'162691-59-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a4487acd23c12096: {'162691-59-0': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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