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Diphenyl 1-(phenylthioureido)-3-methylthiopropanephosphonate
SpectraBase Compound ID IWYo0EFLLtG
InChI InChI=1S/C23H25N2O3PS2/c1-31-18-17-22(25(23(24)30)19-11-5-2-6-12-19)29(26,27-20-13-7-3-8-14-20)28-21-15-9-4-10-16-21/h2-16,22H,17-18H2,1H3,(H2,24,30)
InChIKey VHRANWKKUIPYQN-UHFFFAOYSA-N
Mol Weight 472.56 g/mol
Molecular Formula C23H25N2O3PS2
Exact Mass 472.104422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bj7MaQrfukE
Name Diphenyl 1-(phenylthioureido)-3-methylthiopropanephosphonate
Alternate Name(s) diphenyl 1-[(aminocarbothioyl)anilino]-3-(methylsulfanyl)propylphosphonate
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Formula C23H25N2O3PS2
InChI InChI=1S/C23H25N2O3PS2/c1-31-18-17-22(25(23(24)30)19-11-5-2-6-12-19)29(26,27-20-13-7-3-8-14-20)28-21-15-9-4-10-16-21/h2-16,22H,17-18H2,1H3,(H2,24,30)
InChIKey VHRANWKKUIPYQN-UHFFFAOYSA-N
Molecular Weight 472.558 g/mol
SMILES NC(N(C(CCSC)P(Oc1ccccc1)(Oc1ccccc1)=O)c1ccccc1)=S
SPLASH splash10-002r-0093700000-d1ca140e7e0e0f5c5f54
Source of Spectrum SO-0-1032-4
Wiley ID 1537469