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

*Links on SpectraBase are not permalinks.
2,4-Pentadienoic acid, 3-methyl-5-[4-(1-methylethenyl)-1-cyclohexen-1-yl]-, methyl ester, [S-(E,E)]-
SpectraBase Compound ID AmrQQRWrRK6
InChI InChI=1S/C16H22O2/c1-12(2)15-9-7-14(8-10-15)6-5-13(3)11-16(17)18-4/h5-7,11,15H,1,8-10H2,2-4H3/b6-5+,13-11+/t15-/m1/s1
InChIKey UBXPAXWHSGHMQM-LORRMVPQSA-N
Mol Weight 246.35 g/mol
Molecular Formula C16H22O2
Exact Mass 246.16198 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 3174vcYY23Z
Name 2,4-Pentadienoic acid, 3-methyl-5-[4-(1-methylethenyl)-1-cyclohexen-1-yl]-, methyl ester, [S-(E,E)]-
Alternate Name(s) Methyl (2E,4E)-5-[(4S)-4-isopropenyl-1-cyclohexen-1-yl]-3-methyl-2,4-pentadienoate Methyl ester of (2E,4E)-5-[(S)-4-isopropenyl-1-cyclohexen-1-yl]-3-methyl-2,4-pentadienoic acid
CAS Registry Number 83021-02-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O2
InChI InChI=1S/C16H22O2/c1-12(2)15-9-7-14(8-10-15)6-5-13(3)11-16(17)18-4/h5-7,11,15H,1,8-10H2,2-4H3/b6-5+,13-11+/t15-/m1/s1
InChIKey UBXPAXWHSGHMQM-LORRMVPQSA-N
Molecular Weight 246.350 g/mol
SMILES C(\C=C\(\C=C\C1=CC[C@@](C(=C)C)(CC1)[H])C)(=O)OC
SPLASH splash10-014i-9120000000-c72e24520e4fa2f15cf7
Source of Spectrum H-65-906-0
Wiley ID 1249370