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

*Links on SpectraBase are not permalinks.
docasanoic acid, methyl ester
SpectraBase Compound ID JvdPJ7WGyit
InChI InChI=1S/C23H46O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h3-22H2,1-2H3
InChIKey QSQLTHHMFHEFIY-UHFFFAOYSA-N
Mol Weight 354.6 g/mol
Molecular Formula C23H46O2
Exact Mass 354.349781 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 8wPIHz1Fnrr
Name Docosanoic acid, methyl ester
CAS Registry Number 929-77-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H46O2
InChI InChI=1S/C23H46O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h3-22H2,1-2H3
InChIKey QSQLTHHMFHEFIY-UHFFFAOYSA-N
Molecular Weight 354.619 g/mol
SMILES C(=O)(OC)CCCCCCCCCCCCCCCCCCCCC
SPLASH splash10-00dr-9000000000-c5295c30dcc0a459824d
Source of Spectrum H-77-56-9
Synonyms Behenic acid, methyl ester Methyl behenate Methyl docosanoate n-Docosanoic acid methyl ester Docosanoic acid methyl ester AI3-36456 EINECS 213-207-8 HSDB 2724 KEMESTER 9022 NSC 158426
Wiley ID 1344975