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Docosanoic acid

View entire compound with spectra: 5 NMR, 7 FTIR, 1 Raman, and 16 MS (GC)

Docosanoic acid
SpectraBase Compound ID 9fP21aXc29f
InChI InChI=1S/C22H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h2-21H2,1H3,(H,23,24)
InChIKey UKMSUNONTOPOIO-UHFFFAOYSA-N
Mol Weight 340.6 g/mol
Molecular Formula C22H44O2
Exact Mass 340.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FkByEsPPNG1
Name Fatty acid (Behenic)
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved.
Formula C22H44O2
InChI InChI=1S/C22H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h2-21H2,1H3,(H,23,24)
InChIKey UKMSUNONTOPOIO-UHFFFAOYSA-N
SMILES OC(CCCCCCCCCCCCCCCCCCCCC)=O
SPLASH splash10-0596-9210000000-ff43428bd0a0fb8ae7a3
Source of Spectrum Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences
Synonyms Docosanoic acid