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Tetracosanoic acid, 23-oxo-, methyl ester
SpectraBase Compound ID 17Tdp1xDzeU
InChI InChI=1S/C25H48O3/c1-24(26)22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25(27)28-2/h3-23H2,1-2H3
InChIKey HQVMGAUUVBVVRO-UHFFFAOYSA-N
Mol Weight 396.7 g/mol
Molecular Formula C25H48O3
Exact Mass 396.360345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FNu7igDgGyL
Name Tetracosanoic acid, 23-oxo-, methyl ester
Alternate Name(s) Methyl 23-oxotetracosanoate 23-ketolignoceric acid methyl ester 23-oxotetracosanoic acid methyl ester Methyl 23-oxidanylidenetetracosanoate
CAS Registry Number 56196-16-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H48O3
InChI InChI=1S/C25H48O3/c1-24(26)22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25(27)28-2/h3-23H2,1-2H3
InChIKey HQVMGAUUVBVVRO-UHFFFAOYSA-N
Molecular Weight 396.656 g/mol
SMILES C(C(OC)=O)CCCCCCCCCCCCCCCCCCCCC(C)=O
SPLASH splash10-052f-9000000000-846f6de8b273235fe769
Source of Spectrum G-37-2457-1
Wiley ID 1367665