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5-{alpha.-[bis(Ethoxyphosphonato)methyl}benzyl}-4-oxo-(1,3)-(tetrahydro)diazole-2-thione
SpectraBase Compound ID CeKP9Tm65RP
InChI InChI=1S/C19H30N2O7P2S/c1-5-25-29(23,26-6-2)18(30(24,27-7-3)28-8-4)15(14-12-10-9-11-13-14)16-17(22)21-19(31)20-16/h9-13,15-16,18H,5-8H2,1-4H3,(H2,20,21,22,31)
InChIKey DHOQZMSMNXUUNH-UHFFFAOYSA-N
Mol Weight 492.46 g/mol
Molecular Formula C19H30N2O7P2S
Exact Mass 492.124896 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8PWwYeVpsO
Name 5-{alpha.-[bis(Ethoxyphosphonato)methyl}benzyl}-4-oxo-(1,3)-(tetrahydro)diazole-2-thione
Alternate Name(s) 5-[2,2-bis(diethoxyphosphoryl)-1-phenylethyl]-2-sulfanylidene-4-imidazolidinone 5-[2,2-bis(diethoxyphosphoryl)-1-phenylethyl]-2-sulfanylideneimidazolidin-4-one 5-[2,2-bis(diethoxyphosphoryl)-1-phenyl-ethyl]-2-thioxo-imidazolidin-4-one 5-[2,2-bis(diethoxyphosphoryl)-1-phenyl-ethyl]-2-sulfanylidene-imidazolidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30N2O7P2S
InChI InChI=1S/C19H30N2O7P2S/c1-5-25-29(23,26-6-2)18(30(24,27-7-3)28-8-4)15(14-12-10-9-11-13-14)16-17(22)21-19(31)20-16/h9-13,15-16,18H,5-8H2,1-4H3,(H2,20,21,22,31)
InChIKey DHOQZMSMNXUUNH-UHFFFAOYSA-N
Molecular Weight 492.464 g/mol
SMILES N1C(NC(C(C(P(=O)(OCC)OCC)P(=O)(OCC)OCC)c2ccccc2)C1=O)=S
SPLASH splash10-053u-0017900000-bc448f5ebbad0d7c25d8
Source of Spectrum D1-2003-786-7
Wiley ID 1548375