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5-O-ACETYL-1,2-O-ISOPROPYLIDENE-3-SPIRO-(4'-AMINO-1',1'-DIOXO-2'-N-ACETYL-5'-PHENYL-2',3'-DIHYDRO-ISOTHIAZOLYL)-ALPHA-D-RIBOFURANOSE
SpectraBase Compound ID KS6NRTumLQG
InChI InChI=1S/C20H24N2O8S/c1-11(23)22-20(16(21)15(31(22,25)26)13-8-6-5-7-9-13)14(10-27-12(2)24)28-18-17(20)29-19(3,4)30-18/h5-9,14,17-18H,10,21H2,1-4H3/t14-,17-,18+,20-/m1/s1
InChIKey XMUKCGNMDPLHEV-XUMLPFHTSA-N
Mol Weight 452.48 g/mol
Molecular Formula C20H24N2O8S
Exact Mass 452.125337 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3npYR5QgXax
Name 5-O-ACETYL-1,2-O-ISOPROPYLIDENE-3-SPIRO-(4'-AMINO-1',1'-DIOXO-2'-N-ACETYL-5'-PHENYL-2',3'-DIHYDRO-ISOTHIAZOLYL)-ALPHA-D-RIBOFURANOSE
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24N2O8S
InChI InChI=1S/C20H24N2O8S/c1-11(23)22-20(16(21)15(31(22,25)26)13-8-6-5-7-9-13)14(10-27-12(2)24)28-18-17(20)29-19(3,4)30-18/h5-9,14,17-18H,10,21H2,1-4H3/t14-,17-,18+,20-/m1/s1
InChIKey XMUKCGNMDPLHEV-XUMLPFHTSA-N
Literature Reference Author L.DOMINGUEZ,A.N.V.NHIEN,C.TOMASSI,C.LEN,D.POSTEL,J.MARCO-CON TELLES
Literature Reference Citation J.ORG.CHEM.,69,843(2004)
Literature Reference DOI 10.1021/jo035301g
Molecular Weight 452.479 g/mol
Solvent CDCl3
Source File Reference UWVN21594