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11-methyloctadec-12-enoic acid methyl ester
SpectraBase Compound ID J6EtRClIkp2
InChI InChI=1S/C20H40O2/c1-4-5-6-10-13-16-19(2)17-14-11-8-7-9-12-15-18-20(21)22-3/h19H,4-18H2,1-3H3
InChIKey OHEUQJSREGQWEP-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 IR6eEOEJ7Ad
Name 11-methyloctadec-12-enoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H40O2
InChI InChI=1S/C20H40O2/c1-4-5-6-10-13-16-19(2)17-14-11-8-7-9-12-15-18-20(21)22-3/h19H,4-18H2,1-3H3
InChIKey OHEUQJSREGQWEP-UHFFFAOYSA-N
Instrument Name HP 5890 series II plus-HP 5972
Ionization Type EI
Literature Reference DOI 10.1016/j.jasms.2009.07.020
Molecular Weight 312.538 g/mol
SMILES CCCCCCCC(CCCCCCCCCC(OC)=O)C
SPLASH splash10-0aor-9100000000-bdcec97c48f0f7619d18
Source of Spectrum A7-20-1998-Fig 1a
Wiley ID 1857565