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O,O-Diphenyl-2-n-butylthio-1-(N-phenylthioureido)ethanephosphonate
SpectraBase Compound ID EKS8fcjJ6Wb
InChI InChI=1S/C25H29N2O3PS2/c1-2-3-19-33-20-24(27-25(32)26-21-13-7-4-8-14-21)31(28,29-22-15-9-5-10-16-22)30-23-17-11-6-12-18-23/h4-18,24H,2-3,19-20H2,1H3,(H2,26,27,32)
InChIKey VHKFSRYCHMHVAL-UHFFFAOYSA-N
Mol Weight 500.61 g/mol
Molecular Formula C25H29N2O3PS2
Exact Mass 500.135722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K6dwPiIUIwX
Name O,O-Diphenyl-2-n-butylthio-1-(N-phenylthioureido)ethanephosphonate
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Formula C25H29N2O3PS2
InChI InChI=1S/C25H29N2O3PS2/c1-2-3-19-33-20-24(27-25(32)26-21-13-7-4-8-14-21)31(28,29-22-15-9-5-10-16-22)30-23-17-11-6-12-18-23/h4-18,24H,2-3,19-20H2,1H3,(H2,26,27,32)
InChIKey VHKFSRYCHMHVAL-UHFFFAOYSA-N
Molecular Weight 500.612 g/mol
SMILES N(C(P(Oc1ccccc1)(Oc1ccccc1)=O)CSCCCC)C(Nc1ccccc1)=S
SPLASH splash10-0002-0009100000-2fbbe1198d824e90ee38
Source of Spectrum SO-0-644-8
Synonyms diphenyl 1-[(anilinocarbothioyl)amino]-2-(butylsulfanyl)ethylphosphonate
Wiley ID 1537620