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2-(4-METHOXYPHENYL)-2-THIOXO-4-PHENYL-5-(ORTHO-METHYLPYRYDINIO)-1,3,2-THIAOXOPHOSPHOLANE ETHANOLATE
SpectraBase Compound ID KTcHRfb1a2W
InChI InChI=1S/C21H21NO2PS2.C2H5O/c1-16-8-6-7-15-22(16)21-20(17-9-4-3-5-10-17)24-25(26,27-21)19-13-11-18(23-2)12-14-19;1-2-3/h3-15,20-21H,1-2H3;2H2,1H3/q+1;-1
InChIKey ABKMXAGLYNDKCN-UHFFFAOYSA-N
Mol Weight 459.56 g/mol
Molecular Formula C23H26NO3PS2
Exact Mass 459.109173 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 24XeVwv0n5X
Name 2-(4-METHOXYPHENYL)-2-THIOXO-4-PHENYL-5-(ORTHO-METHYLPYRYDINIO)-1,3,2-THIAOXOPHOSPHOLANE ETHANOLATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H26NO3PS2
InChI InChI=1S/C21H21NO2PS2.C2H5O/c1-16-8-6-7-15-22(16)21-20(17-9-4-3-5-10-17)24-25(26,27-21)19-13-11-18(23-2)12-14-19;1-2-3/h3-15,20-21H,1-2H3;2H2,1H3/q+1;-1
InChIKey ABKMXAGLYNDKCN-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference N.M.YOUSIF (1989) Phosphorus and Sulfur: v.44, N3, 249-254.
NMR Standard not reported
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d