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Pelandjauic acid

View entire compound with spectra: 1 MS (GC)

Pelandjauic acid
SpectraBase Compound ID 1auH3OYDKvv
InChI InChI=1S/C24H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(25)23(21)24(26)27/h6-7,9-10,17,19-20,25H,2-5,8,11-16,18H2,1H3,(H,26,27)/b7-6+,10-9+
InChIKey OFFQPVDOVYHTBX-AVQMFFATSA-N
Mol Weight 372.5 g/mol
Molecular Formula C24H36O3
Exact Mass 372.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lx8Au4fFKzH
Name Pelandjauic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O3
InChI InChI=1S/C24H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(25)23(21)24(26)27/h6-7,9-10,17,19-20,25H,2-5,8,11-16,18H2,1H3,(H,26,27)/b7-6+,10-9+
InChIKey OFFQPVDOVYHTBX-AVQMFFATSA-N
Molecular Weight 372.549 g/mol
SMILES OC(c1c(cccc1CCCCCCC\C=C\C\C=C\CCCCC)O)=O
SPLASH splash10-0uk9-0419000000-780afb161132732bcb45
Source of Spectrum U-1995-2220-11
Synonyms 2-Hydroxy-6-[8',11'-heptadecadienyl]-benzoic acid 2-[(8E,11E)-8,11-heptadecadienyl]-6-hydroxybenzoic acid
Wiley ID 767786