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Hentriacontanoate

View entire compound with spectra: 3 MS (GC)

Hentriacontanoate <methyl->
SpectraBase Compound ID vBrkRvs4ml
InChI InChI=1S/C32H64O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32(33)34-2/h3-31H2,1-2H3
InChIKey SQHVQEYSKBNZDY-UHFFFAOYSA-N
Mol Weight 480.9 g/mol
Molecular Formula C32H64O2
Exact Mass 480.490631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LP9XCBAEYcc
Name Hentriacontanoate
CAS Registry Number 77630-51-4
Classification Fatty esters; Fatty acid methyl esters
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 480.490631299 u
Formula C32H64O2
InChI InChI=1S/C32H64O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32(33)34-2/h3-31H2,1-2H3
InChIKey SQHVQEYSKBNZDY-UHFFFAOYSA-N
Molecular Weight 480.862 g/mol
Number of Peaks 50
RI4 3405
RI5 3000
SMILES C(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)(=O)OC
SPLASH splash10-05gu-9100100000-efe9e132550ee6927578
Sample Comments RI1: measured on Equity-1 (Alkanes) RI2: measured on Supelcowax-10 (FAMEs) RI3: measured on Supelcowax-10 (FAEEs) RI4: measured on SLB-5ms (Alkanes) RI5: measured on SLB-5ms (FAMEs)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Hentriacontanoic acid, methyl ester Me. C31:0
Wiley ID LM_LIPIDS2016_234