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Santalbate <methyl->
SpectraBase Compound ID CWq3nPTBejd
InChI InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h8-9H,3-7,12-18H2,1-2H3/b9-8+
InChIKey QMZUILXAAOEXNR-CMDGGOBGSA-N
Mol Weight 292.5 g/mol
Molecular Formula C19H32O2
Exact Mass 292.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4IyNuZvsH7L
Name Santalbate
CAS Registry Number 34724-42-0
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32O2
InChI InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h8-9H,3-7,12-18H2,1-2H3/b9-8+
InChIKey QMZUILXAAOEXNR-CMDGGOBGSA-N
Number of Peaks 213
RI2 2162
RI4 2222
RI5 1896
SMILES C(CCCCCCCC#C\C=C\CCCCCC)(=O)OC
SPLASH splash10-005c-9300000000-5c21c0768f0e043c950e
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 11-Octadecen-9-ynoic acid, methyl ester, (11E)
Wiley ID LM_LIPIDS2016_210