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3',5'-DI-O-ACETYL-2'-S-(4-METHOXYPHENYL)-2'-THIOURIDINE

View entire compound with spectra: 1 NMR

3',5'-DI-O-ACETYL-2'-S-(4-METHOXYPHENYL)-2'-THIOURIDINE
SpectraBase Compound ID AExspibl1R3
InChI InChI=1S/C20H22N2O8S/c1-11(23)28-10-15-17(29-12(2)24)18(31-14-6-4-13(27-3)5-7-14)19(30-15)22-9-8-16(25)21-20(22)26/h4-9,15,17-19H,10H2,1-3H3,(H,21,25,26)/t15-,17-,18-,19-/m0/s1
InChIKey OKMVLTRUULPVER-WNHJNPCNSA-N
Mol Weight 450.46 g/mol
Molecular Formula C20H22N2O8S
Exact Mass 450.109687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6sthXY71Y9W
Name 3',5'-DI-O-ACETYL-2'-S-(4-METHOXYPHENYL)-2'-THIOURIDINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22N2O8S
InChI InChI=1S/C20H22N2O8S/c1-11(23)28-10-15-17(29-12(2)24)18(31-14-6-4-13(27-3)5-7-14)19(30-15)22-9-8-16(25)21-20(22)26/h4-9,15,17-19H,10H2,1-3H3,(H,21,25,26)/t15-,17-,18-,19-/m0/s1
InChIKey OKMVLTRUULPVER-WNHJNPCNSA-N
Literature Reference Author M.J.ROBINS,K.B.MULLAH,S.F.WNUK,N.K.DALLEY
Literature Reference Citation J.ORG.CHEM.,57,2357(1992)
Literature Reference DOI 10.1021/jo00034a031
Molecular Weight 450.463 g/mol
Solvent DMSO-D6
Source File Reference UWCS1442