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(1R)-2-(3-CYANO-4,6-DIMETHYL-2-OXOPYRIDIN-1(2H)-YL)-1-[[(4-METHYLBENZENESULFONYL)-OXY]-METHYL]-ETHYL-4-METHYLBENZENE-SULFONATE

View entire compound with spectra: 1 NMR

(1R)-2-(3-CYANO-4,6-DIMETHYL-2-OXOPYRIDIN-1(2H)-YL)-1-[[(4-METHYLBENZENESULFONYL)-OXY]-METHYL]-ETHYL-4-METHYLBENZENE-SULFONATE
SpectraBase Compound ID EsKL7ooqyAr
InChI InChI=1S/C25H26N2O7S2/c1-17-5-9-22(10-6-17)35(29,30)33-16-21(34-36(31,32)23-11-7-18(2)8-12-23)15-27-20(4)13-19(3)24(14-26)25(27)28/h5-13,21H,15-16H2,1-4H3/t21-/m0/s1
InChIKey DEJIZMPHAHIHJU-NRFANRHFSA-N
Mol Weight 530.61 g/mol
Molecular Formula C25H26N2O7S2
Exact Mass 530.118144 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JWwYRAmXwUO
Name (1R)-2-(3-CYANO-4,6-DIMETHYL-2-OXOPYRIDIN-1(2H)-YL)-1-[[(4-METHYLBENZENESULFONYL)-OXY]-METHYL]-ETHYL-4-METHYLBENZENE-SULFONATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H26N2O7S2
InChI InChI=1S/C25H26N2O7S2/c1-17-5-9-22(10-6-17)35(29,30)33-16-21(34-36(31,32)23-11-7-18(2)8-12-23)15-27-20(4)13-19(3)24(14-26)25(27)28/h5-13,21H,15-16H2,1-4H3/t21-/m0/s1
InChIKey DEJIZMPHAHIHJU-NRFANRHFSA-N
Literature Reference Author F.A.EL-ESSAWY,A.F.KHATTAB
Literature Reference Citation J.HETCYCL.CHEM.,41,311(2004)
Literature Reference DOI 10.1002/jhet.5570410302
Molecular Weight 530.611 g/mol
Solvent CDCl3
Source File Reference UWLU22265