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Benzyl docosanoate
SpectraBase Compound ID DBiXpP9LEY1
InChI InChI=1S/C29H50O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-29(30)31-27-28-24-21-20-22-25-28/h20-22,24-25H,2-19,23,26-27H2,1H3
InChIKey FYOGVGKALAEVBF-UHFFFAOYSA-N
Mol Weight 430.7 g/mol
Molecular Formula C29H50O2
Exact Mass 430.381081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID cB6OGCRoQ9
Name Benzyl docosanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H50O2
InChI InChI=1S/C29H50O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-29(30)31-27-28-24-21-20-22-25-28/h20-22,24-25H,2-19,23,26-27H2,1H3
InChIKey FYOGVGKALAEVBF-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890N
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202100285
Molecular Weight 430.717 g/mol
SMILES c1(ccccc1)COC(CCCCCCCCCCCCCCCCCCCCC)=O
SPLASH splash10-052f-9300000000-0e0265a6c46998474b96
Source of Spectrum CBD-18-SM11-11-2
Wiley ID 1865175