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Hexacosanoic acid, 9-oxo-, methyl ester
SpectraBase Compound ID 62CbLbg1PSm
InChI InChI=1S/C27H52O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23-26(28)24-21-18-16-19-22-25-27(29)30-2/h3-25H2,1-2H3
InChIKey CPXVTKNQCMDWFS-UHFFFAOYSA-N
Mol Weight 424.7 g/mol
Molecular Formula C27H52O3
Exact Mass 424.391646 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CT37KdZStn9
Name Hexacosanoic acid, 9-oxo-, methyl ester
Alternate Name(s) Methyl 9-oxohexacosanoate 9-ketocerotic acid methyl ester 9-Oxohexacosanoic acid methyl ester Methyl 9-oxidanylidenehexacosanoate
CAS Registry Number 55955-49-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H52O3
InChI InChI=1S/C27H52O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23-26(28)24-21-18-16-19-22-25-27(29)30-2/h3-25H2,1-2H3
InChIKey CPXVTKNQCMDWFS-UHFFFAOYSA-N
Molecular Weight 424.710 g/mol
SMILES C(C(CCCCCCCCCCCCCCCCC)=O)CCCCCCC(OC)=O
SPLASH splash10-0k96-8930000000-695720f0dc99ab3ebf9d
Source of Spectrum S-18-89-4
Wiley ID 1379437