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Octadecanoic acid

View entire compound with spectra: 14 NMR, 76 FTIR, 3 Raman, and 57 MS (GC)

Octadecanoic acid
SpectraBase Compound ID ITpqoQGWENW
InChI InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)
InChIKey QIQXTHQIDYTFRH-UHFFFAOYSA-N
Mol Weight 284.5 g/mol
Molecular Formula C18H36O2
Exact Mass 284.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cg8UqKeFCFc
Name Stearic Acid
Classification Long-chain fatty acids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 284.271530397 u
Formula C18H36O2
InChI InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)
InChIKey QIQXTHQIDYTFRH-UHFFFAOYSA-N
Molecular Weight 284.484 g/mol
Number of Peaks 83
SMILES OC(CCCCCCCCCCCCCCCCC)=O
SPLASH splash10-0c03-9100000000-8bea886a8bc69b959a89
Source of Spectrum SWG-33-1902-0
Synonyms Octadecanoic acid
Wiley ID 1809428