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Benzyl 23-methylpentacosanoate
SpectraBase Compound ID 9BRQ5f3VCZ1
InChI InChI=1S/C33H58O2/c1-3-31(2)26-22-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-25-29-33(34)35-30-32-27-23-21-24-28-32/h21,23-24,27-28,31H,3-20,22,25-26,29-30H2,1-2H3
InChIKey VSEKVFRARVKAFN-UHFFFAOYSA-N
Mol Weight 486.8 g/mol
Molecular Formula C33H58O2
Exact Mass 486.443681 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DzDKQ63ZdF2
Name Benzyl 23-methylpentacosanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H58O2
InChI InChI=1S/C33H58O2/c1-3-31(2)26-22-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-25-29-33(34)35-30-32-27-23-21-24-28-32/h21,23-24,27-28,31H,3-20,22,25-26,29-30H2,1-2H3
InChIKey VSEKVFRARVKAFN-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890N
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202100285
Molecular Weight 486.825 g/mol
SMILES c1(ccccc1)COC(CCCCCCCCCCCCCCCCCCCCCC(CC)C)=O
SPLASH splash10-052f-9400000000-afb2c77f54af173ef5ed
Source of Spectrum CBD-18-SM11-11-9
Wiley ID 1865181