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Octanoic acid, 7-(diphenylphosphinyl)-6-oxo-, methyl ester, (.+-.)-
SpectraBase Compound ID BzqCazkNLKa
InChI InChI=1S/C21H25O4P/c1-17(20(22)15-9-10-16-21(23)25-2)26(24,18-11-5-3-6-12-18)19-13-7-4-8-14-19/h3-8,11-14,17H,9-10,15-16H2,1-2H3
InChIKey NHYAHFPIOFOING-UHFFFAOYSA-N
Mol Weight 372.4 g/mol
Molecular Formula C21H25O4P
Exact Mass 372.149046 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 53cZO6JBcg4
Name Octanoic acid, 7-(diphenylphosphinyl)-6-oxo-, methyl ester, (.+-.)-
Alternate Name(s) 7-Diphenylphosphinoyl-6-oxo-octanoate Methyl 7-(diphenylphosphoryl)-6-oxooctanoate
CAS Registry Number 119106-51-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25O4P
InChI InChI=1S/C21H25O4P/c1-17(20(22)15-9-10-16-21(23)25-2)26(24,18-11-5-3-6-12-18)19-13-7-4-8-14-19/h3-8,11-14,17H,9-10,15-16H2,1-2H3
InChIKey NHYAHFPIOFOING-UHFFFAOYSA-N
Molecular Weight 372.401 g/mol
SMILES C(P(=O)(c1ccccc1)c1ccccc1)(C(=O)CCCCC(=O)OC)C
SPLASH splash10-0udi-0092000000-6236e280cc593b80fcd1
Source of Spectrum KC-1988-1804-9
Wiley ID 1355506