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METHYL-2-CYANO-3-METHYLTHIO-3-(DI-ISO-PROPOXYPHOSPHONYL)-ACRYLATE
SpectraBase Compound ID 4c8vjf4lL0D
InChI InChI=1S/2C12H20NO5PS/c2*1-8(2)17-19(15,18-9(3)4)12(20-6)10(7-13)11(14)16-5/h2*8-9H,1-6H3/b12-10+;12-10-
InChIKey YHIUREGHMYTDEW-ACMBVHBRSA-N
Mol Weight 642.66 g/mol
Molecular Formula C24H40N2O10P2S2
Exact Mass 642.159962 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BdbwyEQEJbr
Name METHYL-2-CYANO-3-METHYLTHIO-3-(DI-ISO-PROPOXYPHOSPHONYL)-ACRYLATE
Compound Number 2R
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H40N2O10P2S2
InChI InChI=1S/2C12H20NO5PS/c2*1-8(2)17-19(15,18-9(3)4)12(20-6)10(7-13)11(14)16-5/h2*8-9H,1-6H3/b12-10+;12-10-
InChIKey YHIUREGHMYTDEW-ACMBVHBRSA-N
Literature Reference Author Y.P.LV,X.Y.WANG,B.A.SONG,S.YANG,K.YAN,G.F.XU,P.S.BHADURY,F.L IU,L.H.JIN,D.Y.HU
Literature Reference Citation MOLECULES,12,965(2007)
Literature Reference DOI 10.3390/12050965
Molecular Weight 642.657 g/mol
Sample ID 46372
Solvent CDCl3