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

*Links on SpectraBase are not permalinks.
(+)-(S)-ABSCISIC-ACID-METHYLESTER
SpectraBase Compound ID LsWBq86KrJl
InChI InChI=1S/C16H22O4/c1-11(8-14(18)20-5)6-7-16(19)12(2)9-13(17)10-15(16,3)4/h6-9,19H,10H2,1-5H3/b7-6+,11-8+/t16-/m1/s1
InChIKey HHDYPZVHXGPCRG-NWYHZMQGSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 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 9PZU7FxHEWo
Name (2E,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxo-1-cyclohex-2-enyl]-3-methylpenta-2,4-dienoic acid methyl ester
Alternate Name(s) (2E,4E)-5-[(1S)-1-hydroxy-4-keto-2,6,6-trimethyl-cyclohex-2-en-1-yl]-3-methyl-penta-2,4-dienoic acid methyl ester Methyl (2E,4E)-3-methyl-5-[(1S)-2,6,6-trimethyl-1-oxidanyl-4-oxidanylidene-cyclohex-2-en-1-yl]penta-2,4-dienoate Methyl (2E,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxo-cyclohex-2-en-1-yl]-3-methyl-penta-2,4-dienoate
CAS Registry Number 79434-13-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-11(8-14(18)20-5)6-7-16(19)12(2)9-13(17)10-15(16,3)4/h6-9,19H,10H2,1-5H3/b7-6+,11-8+/t16-/m1/s1
InChIKey HHDYPZVHXGPCRG-NWYHZMQGSA-N
Molecular Weight 278.348 g/mol
SMILES O[C@@]1(C(=CC(CC1(C)C)=O)C)\C=C\C(=C\C(=O)OC)C
SPLASH splash10-0006-0900000000-2e0d4acd2d48d4c9a813
Source of Spectrum H-73-1011-7
Wiley ID 1282069