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N-ISOPROPYL-N-[(4-METHOXYPHENYL)-(METHYLTHIO)-THIOPHOSPHONYLOXY]-4-NITROBENZAMIDE
SpectraBase Compound ID I36Q3HEB4im
InChI InChI=1S/C18H21N2O5PS2/c1-13(2)19(18(21)14-5-7-15(8-6-14)20(22)23)25-26(27,28-4)17-11-9-16(24-3)10-12-17/h5-13H,1-4H3
InChIKey YDHPEDJKVZOXIC-UHFFFAOYSA-N
Mol Weight 440.47 g/mol
Molecular Formula C18H21N2O5PS2
Exact Mass 440.062951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KPSc4LqCdyE
Name N-Isopropyl-N-[(p-methoxyphenyl)(methylthio)-thiophosphonyloxy]-4-nitrobenzamide
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Formula C18H21N2O5PS2
InChI InChI=1S/C18H21N2O5PS2/c1-13(2)19(18(21)14-5-7-15(8-6-14)20(22)23)25-26(27,28-4)17-11-9-16(24-3)10-12-17/h5-13H,1-4H3
InChIKey YDHPEDJKVZOXIC-UHFFFAOYSA-N
Molecular Weight 440.469 g/mol
SMILES C(N(OP(c1ccc(cc1)OC)(=S)SC)C(C)C)(c1ccc(N(=O)=O)cc1)=O
SPLASH splash10-014i-0981000000-51a65f063560f04861d0
Source of Spectrum H-2005-2012-22
Synonyms N-[(4-methoxyphenyl)-(methylthio)phosphinothioyl]oxy-4-nitro-N-propan-2-ylbenzamide N-[(4-methoxyphenyl)-methylsulfanylphosphinothioyl]oxy-4-nitro-N-propan-2-ylbenzamide N-isopropyl-N-[(4-methoxyphenyl)-methylsulfanyl-phosphinothioyl]oxy-4-nitro-benzamide N-[(4-methoxyphenyl)-methylsulfanyl-phosphinothioyl]oxy-4-nitro-N-propan-2-yl-benzamide
Wiley ID 1562687