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Benzyl 26-methyloctacosanoate
SpectraBase Compound ID oPYwJm4Ejk
InChI InChI=1S/C36H64O2/c1-3-34(2)29-25-22-20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-21-23-28-32-36(37)38-33-35-30-26-24-27-31-35/h24,26-27,30-31,34H,3-23,25,28-29,32-33H2,1-2H3
InChIKey VHLHETVUBSKGTD-UHFFFAOYSA-N
Mol Weight 528.9 g/mol
Molecular Formula C36H64O2
Exact Mass 528.490631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LfiA8Gzp7iD
Name Benzyl 26-methyloctacosanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H64O2
InChI InChI=1S/C36H64O2/c1-3-34(2)29-25-22-20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-21-23-28-32-36(37)38-33-35-30-26-24-27-31-35/h24,26-27,30-31,34H,3-23,25,28-29,32-33H2,1-2H3
InChIKey VHLHETVUBSKGTD-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890N
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202100285
Molecular Weight 528.906 g/mol
SMILES c1(ccccc1)COC(CCCCCCCCCCCCCCCCCCCCCCCCC(CC)C)=O
SPLASH splash10-052f-9400100000-fa932cf76f2d26635d97
Source of Spectrum CBD-18-SM12-12-8
Wiley ID 1865186