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Oleic methyl ester phosphonic ester me

View entire compound with spectra: 1 NMR, 2 FTIR, and 1 Raman

Oleic methyl ester phosphonic ester me
SpectraBase Compound ID C2cDLImi54d
InChI InChI=1S/C21H43O5P/c1-5-6-7-8-11-14-17-20(27(23,25-3)26-4)18-15-12-9-10-13-16-19-21(22)24-2/h20H,5-19H2,1-4H3
InChIKey JOWVBZGOEHZPAB-UHFFFAOYSA-N
Mol Weight 406.5 g/mol
Molecular Formula C21H43O5P
Exact Mass 406.284811 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID IVpFJhQhm35
Name Oleic methyl ester phosphonic ester me
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.284811478 u
Formula C21H43O5P
InChI InChI=1S/C21H43O5P/c1-5-6-7-8-11-14-17-20(27(23,25-3)26-4)18-15-12-9-10-13-16-19-21(22)24-2/h20H,5-19H2,1-4H3
InChIKey JOWVBZGOEHZPAB-UHFFFAOYSA-N
Molecular Weight 406.544 g/mol
SMILES C(CC)CCCCCC(CCCCCCCCC(=O)OC)P(=O)(OC)OC
Spectrum/Structure Validation Score (Raman) 0.97475