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2-[(5-chloro-2,4-dimethoxyphenyl)thiocarbamoyl]phosphorohydrazidothioic acid, O,O-bis(p-tert-butylphenyl) ester
SpectraBase Compound ID HxRWdd4bE7F
InChI InChI=1S/C29H37ClN3O4PS2/c1-28(2,3)19-9-13-21(14-10-19)36-38(40,37-22-15-11-20(12-16-22)29(4,5)6)33-32-27(39)31-24-17-23(30)25(34-7)18-26(24)35-8/h9-18H,1-8H3,(H,33,40)(H2,31,32,39)
InChIKey NKROYCSZMANZTE-UHFFFAOYSA-N
Mol Weight 622.2 g/mol
Molecular Formula C29H37ClN3O4PS2
Exact Mass 621.165164 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Ag14tS37B4
Name 2-[(5-chloro-2,4-dimethoxyphenyl)thiocarbamoyl]phosphorohydrazidothioic acid, O,O-bis(p-tert-butylphenyl) ester
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Formula C29H37ClN3O4PS2
InChI InChI=1S/C29H37ClN3O4PS2/c1-28(2,3)19-9-13-21(14-10-19)36-38(40,37-22-15-11-20(12-16-22)29(4,5)6)33-32-27(39)31-24-17-23(30)25(34-7)18-26(24)35-8/h9-18H,1-8H3,(H,33,40)(H2,31,32,39)
InChIKey NKROYCSZMANZTE-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 59412M
Solvent DMSO-d6