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Eicosanoic acid

View entire compound with spectra: 8 NMR, 7 FTIR, 1 Raman, and 19 MS (GC)

Eicosanoic acid
SpectraBase Compound ID JDFxuc3N5W4
InChI InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)
InChIKey VKOBVWXKNCXXDE-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C20H40O2
Exact Mass 312.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8frtcbKOXmM
Name Icosanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H40O2
InChI InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)
InChIKey VKOBVWXKNCXXDE-UHFFFAOYSA-N
Instrument Name Carlo Erba QMD 1000 or Fisons MD800
Ionization Type EI
Literature Reference DOI 10.1021/np1008366
SMILES OC(CCCCCCCCCCCCCCCCCCC)=O
SPLASH splash10-06r6-9000000000-d8e411eb9a9a75e1d13c
Source of Spectrum G4-74-SM3-40
Wiley ID 1849147