CHEBI:184320 - 1-Isopropyl-4-methylcyclohex-3-en-1-yl acetate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 1-Isopropyl-4-methylcyclohex-3-en-1-yl acetate
ChEBI ID CHEBI:184320
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H20O2
Net Charge 0
Average Mass 196.290
Monoisotopic Mass 196.14633
InChI InChI=1S/C12H20O2/c1-9(2)12(14-11(4)13)7-5-10(3)6-8-12/h5,9H,6-8H2,1-4H3
InChIKey BFCBRSFYYLSTAA-UHFFFAOYSA-N
SMILES O(C1(C(C)C)CCC(=CC1)C)C(=O)C
Metabolite of Species Details
Bos taurus (NCBI:txid9913) Found in spermatozoon (BTO:0001277). of strain Holstein-Friesian cattle [26105007] See: MetaboLights Study
Bos taurus (NCBI:txid9913) Found in spermatozoon (FMA:67338). of strain Holstein-Friesian cattle [26105007] See: MetaboLights Study
ChEBI Ontology
Outgoing 1-Isopropyl-4-methylcyclohex-3-en-1-yl acetate (CHEBI:184320) is a p-menthane monoterpenoid (CHEBI:25186)
IUPAC Name
(4-methyl-1-propan-2-ylcyclohex-3-en-1-yl) acetate
Manual Xref Database
19717 ChemSpider
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Registry Number Type Source
4821-04-9 CAS Registry Number ChemIDplus