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2-BUTOXY(BENZOYLMETHYL)PHOSPHORYL-3-BUTOXY-5,6-DIMETHYLTHIAZOLO[2,3-D]-1,2-DIHYDRO-1,2,4,3-TRIAZAPHOSPHOLE
SpectraBase Compound ID 3iDg07G6qRX
InChI InChI=1S/C21H31N3O4P2S/c1-5-7-14-27-29-23-17(3)18(4)31-21(23)22-24(29)30(26,28-15-8-6-2)16-20(25)19-12-10-9-11-13-19/h9-13H,5-8,14-16H2,1-4H3
InChIKey CZDZQVHQASMEMN-UHFFFAOYSA-N
Mol Weight 483.5 g/mol
Molecular Formula C21H31N3O4P2S
Exact Mass 483.151052 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DuwAoFIQuKA
Name 2-BUTOXY(BENZOYLMETHYL)PHOSPHORYL-3-BUTOXY-5,6-DIMETHYLTHIAZOLO[2,3-D]-1,2-DIHYDRO-1,2,4,3-TRIAZAPHOSPHOLE
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Formula C21H31N3O4P2S
InChI InChI=1S/C21H31N3O4P2S/c1-5-7-14-27-29-23-17(3)18(4)31-21(23)22-24(29)30(26,28-15-8-6-2)16-20(25)19-12-10-9-11-13-19/h9-13H,5-8,14-16H2,1-4H3
InChIKey CZDZQVHQASMEMN-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference J.-L.ZHANG, W.XU (1989) Phosphorus and Sulfur: v.46, N1, 7-24.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported