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

*Links on SpectraBase are not permalinks.
GARCINOIC-ACID
SpectraBase Compound ID FOPCuwDkpOD
InChI InChI=1S/C27H38O4/c1-19(11-7-13-21(3)26(29)30)9-6-10-20(2)12-8-15-27(5)16-14-23-18-24(28)17-22(4)25(23)31-27/h9,12-13,17-18,28H,6-8,10-11,14-16H2,1-5H3,(H,29,30)/b19-9+,20-12+,21-13+
InChIKey QOFWRHWADNWKSU-PWSCZGNTSA-N
Mol Weight 426.6 g/mol
Molecular Formula C27H38O4
Exact Mass 426.27701 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 FCvPMeq2loT
Name (2E,6E,10E)-13-(2,8-dimethyl-6-oxidanyl-3,4-dihydrochromen-2-yl)-2,6,10-trimethyl-trideca-2,6,10-trienoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H38O4
InChI InChI=1S/C27H38O4/c1-19(11-7-13-21(3)26(29)30)9-6-10-20(2)12-8-15-27(5)16-14-23-18-24(28)17-22(4)25(23)31-27/h9,12-13,17-18,28H,6-8,10-11,14-16H2,1-5H3,(H,29,30)/b19-9+,20-12+,21-13+
InChIKey QOFWRHWADNWKSU-PWSCZGNTSA-N
Molecular Weight 426.597 g/mol
SMILES OC(\C(=C\CC\C(=C\CC\C(=C\CCC1(Oc2c(cc(cc2CC1)O)C)C)C)C)C)=O
SPLASH splash10-002u-3900200000-0a1fe3b12aba5316c126
Source of Spectrum H1-45-1563-1
Synonyms (2E,6E,10E)-13-(6-hydroxy-2,8-dimethyl-3,4-dihydro-2H-1-benzopyran-2-yl)-2,6,10-trimethyltrideca-2,6,10-trienoic acid (2E,6E,10E)-13-(6-hydroxy-2,8-dimethyl-3,4-dihydrochromen-2-yl)-2,6,10-trimethyltrideca-2,6,10-trienoic acid (2E,6E,10E)-13-(6-hydroxy-2,8-dimethyl-chroman-2-yl)-2,6,10-trimethyl-trideca-2,6,10-trienoic acid
Wiley ID 815782