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C8 bis Diethylphosphonate

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

C8 bis Diethylphosphonate
SpectraBase Compound ID 9sjvC36hSIi
InChI InChI=1S/C16H36O6P2/c1-5-19-23(17,20-6-2)15-13-11-9-10-12-14-16-24(18,21-7-3)22-8-4/h5-16H2,1-4H3
InChIKey BEWTYNZLBMSWOS-UHFFFAOYSA-N
Mol Weight 386.4 g/mol
Molecular Formula C16H36O6P2
Exact Mass 386.198713 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 4Aa19wWXZjH
Name C8 bis Diethylphosphonate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.198712869 u
Formula C16H36O6P2
InChI InChI=1S/C16H36O6P2/c1-5-19-23(17,20-6-2)15-13-11-9-10-12-14-16-24(18,21-7-3)22-8-4/h5-16H2,1-4H3
InChIKey BEWTYNZLBMSWOS-UHFFFAOYSA-N
Molecular Weight 386.406 g/mol
SMILES C(P(=O)(OCC)OCC)CCCCCCCP(=O)(OCC)OCC
Spectrum/Structure Validation Score (Raman) 0.948793