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A Mixture Of: Trans-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran; Cis-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran

UUID 3249f5b2-354a-4eec-853d-f4740dcdd845
Flow Object IDfo-565e81fa4fe44dbc
Source EF 3.1
Context Environmental → Water → Ocean
CAS Numbers 131766-73-9
EC Numbers 412-450-9
prefLabel
Language Value Provenance
en A Mixture Of: Trans-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran; Cis-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran
altLabel ⓘ
Language Value Provenance
en (4-methyl-2-propyloxan-4-yl) acetate
en 2<em>H</em>-Pyran-4-ol, tetrahydro-4-methyl-2-propyl-, 4-acetate
en 2<em>H</em>-Pyran-4-ol, tetrahydro-4-methyl-2-propyl-, acetate
en 4-Acetoxy-4-methyl-2-propyltetrahydro-2<em>H</em>-pyran
en Clarycet
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey GURYYNWDVKXZAT-UHFFFAOYSA-N
InChI InChI=1S/C11H20O3/c1-4-5-10-8-11(3,6-7-13-10)14-9(2)12/h10H,4-8H2,1-3H3
IUPAC name (4-methyl-2-propyl-oxan-4-yl) ethanoate, (4-methyl-2-propyl-tetrahydropyran-4-yl) acetate, (4-methyl-2-propyloxan-4-yl) acetate, acetic acid (4-methyl-2-propyl-4-oxanyl) ester, acetic acid (4-methyl-2-propyl-tetrahydropyran-4-yl) ester
Molecular formula C11H20O3
Molecular mass 200.278
Monoisotopic mass 200.14124
SMILES CCCC1CC(C)(OC(C)=O)CCO1, CCCC1CC(CCO1)(C)OC(=O)C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 3249f5b2-354a-4eec-853d-f4740dcdd845 a mixture of: trans-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran; cis-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 a mixture of: trans-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran; cis-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran Emissions/Emissions to water/Emissions to sea water 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=amixtureof:trans-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran;cis-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran||dimension=Environmental > media=Ground > geography=Unknown; cas=131766-73-9; added Common Chemistry CAS names as altLabel: 2<em>H</em>-Pyran-4-ol, tetrahydro-4-methyl-2-propyl-, 4-acetate, 2<em>H</em>-Pyran-4-ol, tetrahydro-4-methyl-2-propyl-, acetate, 4-Acetoxy-4-methyl-2-propyltetrahydro-2<em>H</em>-pyran, Clarycet; object_uuid=fo-565e81fa4fe44dbc
cas_match_labels 1 — consensus_match group_key=amixtureof:trans-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran;cis-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi']; cas_sources={'131766-73-9': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-565e81fa4fe44dbc: {'131766-73-9': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyOcean

Consensus Changes

Field Old Value New Value Comment
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cas_match_labels None {'131766-73-9': 'exactMatch'} group_key=amixtureof:trans-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran;cis-4-acetoxy-4-methyl-2-propyl-tetrahydro-2h-pyran||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi']; cas_sources={'131766-73-9': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-565e81fa4fe44dbc: {'131766-73-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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