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benzyl tetracosanoate
SpectraBase Compound ID IfSxaBycteh
InChI InChI=1S/C31H54O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-28-31(32)33-29-30-26-23-22-24-27-30/h22-24,26-27H,2-21,25,28-29H2,1H3
InChIKey ZUUNXRXNMCSNJN-UHFFFAOYSA-N
Mol Weight 458.8 g/mol
Molecular Formula C31H54O2
Exact Mass 458.412381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JjHI1ni5JX1
Name benzyl tetracosanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H54O2
InChI InChI=1S/C31H54O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-28-31(32)33-29-30-26-23-22-24-27-30/h22-24,26-27H,2-21,25,28-29H2,1H3
InChIKey ZUUNXRXNMCSNJN-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890N
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202100285
Molecular Weight 458.771 g/mol
SMILES c1(ccccc1)COC(CCCCCCCCCCCCCCCCCCCCCCC)=O
SPLASH splash10-052f-9200000000-d2e54174ca15aef3bd32
Source of Spectrum CBD-18-SM20-Figure S9-1
Wiley ID 1865227