For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-Cyclohexene-1-carboxylic acid, 4-(1,5-dimethyl-3-oxo-4-hexenyl)-, methyl ester, [S-(R*,S*)]-
SpectraBase Compound ID HGtLeOX3nhy
InChI InChI=1S/C16H24O3/c1-11(2)9-15(17)10-12(3)13-5-7-14(8-6-13)16(18)19-4/h7,9,12-13H,5-6,8,10H2,1-4H3/t12-,13-/m1/s1
InChIKey DEMNMQDWPCIOLA-CHWSQXEVSA-N
Mol Weight 264.36 g/mol
Molecular Formula C16H24O3
Exact Mass 264.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IFfSWypd0E
Name 1-Cyclohexene-1-carboxylic acid, 4-(1,5-dimethyl-3-oxo-4-hexenyl)-, methyl ester, [S-(R*,S*)]-
CAS Registry Number 65621-12-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O3
InChI InChI=1S/C16H24O3/c1-11(2)9-15(17)10-12(3)13-5-7-14(8-6-13)16(18)19-4/h7,9,12-13H,5-6,8,10H2,1-4H3/t12-,13-/m1/s1
InChIKey DEMNMQDWPCIOLA-CHWSQXEVSA-N
Molecular Weight 264.365 g/mol
SMILES C1(C(=O)OC)=CC[C@](CC1)([C@@](CC(C=C(C)C)=O)(C)[H])[H]
SPLASH splash10-0a4i-7290000000-5c9e2e75a332d7178639
Source of Spectrum F-40-2964-0
Synonyms (+)-.delta.7-Dehydrojuvabione 4'-Dehydroepijuvabione Methyl (4S)-4-[(1R)-1,5-dimethyl-3-oxo-4-hexenyl]-1-cyclohexene-1-carboxylate
Wiley ID 1268217