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Eicosanoic acid methyl ester
SpectraBase Compound ID 1Bxn5pwa9WL
InChI InChI=1S/C21H42O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h3-20H2,1-2H3
InChIKey QGBRLVONZXHAKJ-UHFFFAOYSA-N
Mol Weight 326.6 g/mol
Molecular Formula C21H42O2
Exact Mass 326.318481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLnulSgfoOn
Name Eicosanoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H42O2
InChI InChI=1S/C21H42O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h3-20H2,1-2H3
InChIKey QGBRLVONZXHAKJ-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.201900588
Molecular Weight 326.565 g/mol
SMILES C(CCCCCCCCCCCCCCC(OC)=O)CCCC
SPLASH splash10-00du-9100000000-6ae12a6f2255b0ae73fe
Source of Spectrum CBD-17-SM26-20:0
Wiley ID 1855856