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O,O-Diphenyl-2-methylthio-1-(N-phenylthioureido)ethanephosphonate
SpectraBase Compound ID 8TfC0zabqfE
InChI InChI=1S/C22H23N2O3PS2/c1-30-17-21(24-22(29)23-18-11-5-2-6-12-18)28(25,26-19-13-7-3-8-14-19)27-20-15-9-4-10-16-20/h2-16,21H,17H2,1H3,(H2,23,24,29)
InChIKey RFKCVRULJAWKQC-UHFFFAOYSA-N
Mol Weight 458.53 g/mol
Molecular Formula C22H23N2O3PS2
Exact Mass 458.088772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GinHrJXV6CW
Name O,O-Diphenyl-2-methylthio-1-(N-phenylthioureido)ethanephosphonate
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Formula C22H23N2O3PS2
InChI InChI=1S/C22H23N2O3PS2/c1-30-17-21(24-22(29)23-18-11-5-2-6-12-18)28(25,26-19-13-7-3-8-14-19)27-20-15-9-4-10-16-20/h2-16,21H,17H2,1H3,(H2,23,24,29)
InChIKey RFKCVRULJAWKQC-UHFFFAOYSA-N
Molecular Weight 458.531 g/mol
SMILES N(C(P(Oc1ccccc1)(Oc1ccccc1)=O)CSC)C(Nc1ccccc1)=S
SPLASH splash10-0a4i-0009000000-9351a72a47455bb30323
Source of Spectrum SO-0-644-8
Synonyms diphenyl 1-[(anilinocarbothioyl)amino]-2-(methylsulfanyl)ethylphosphonate
Wiley ID 1537625