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docasanoic acid, methyl ester

View entire compound with spectra: 7 NMR, 6 FTIR, and 31 MS (GC)

docasanoic acid, methyl ester
SpectraBase Compound ID JvdPJ7WGyit
InChI InChI=1S/C23H46O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h3-22H2,1-2H3
InChIKey QSQLTHHMFHEFIY-UHFFFAOYSA-N
Mol Weight 354.6 g/mol
Molecular Formula C23H46O2
Exact Mass 354.349781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EQWrSf937GG
Name Methyl docosanoate
Comments MONAID: JP002666
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H46O2
InChI InChI=1S/C23H46O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h3-22H2,1-2H3
InChIKey QSQLTHHMFHEFIY-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 354.619 g/mol
SMILES CCCCCCCCCCCCCCCCCCCCCC(=O)OC
SPLASH splash10-000i-9623000000-099ee830312eef1dc770
Source of Spectrum SRH-2022-2666-0
Wiley ID 1825021