John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=H9s3oNWCEX6 SpectraBase Spectrum ID=2V0uca2ToQ5

(accessed ).
#15D;[1-[2',5'-BIS-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-RIBOFURANOSYL]-THYMINE]-3'-SPIRO-5''-(4''-AMINO-3''-(E)-(1-HYDROXY-2-PROPENYLENO)-1'',2''-OXATHIOLE-2'',2''-DIO
SpectraBase Compound ID H9s3oNWCEX6
InChI InChI=1S/C27H47N3O9SSi2/c1-17-15-30(24(33)29-22(17)32)23-21(38-42(10,11)26(5,6)7)27(19(37-23)16-36-41(8,9)25(2,3)4)20(28)18(13-12-14-31)40(34,35)39-27/h12-13,15,19,21,23,31H,14,16,28H2,1-11H3,(H,29,32,33)/b13-12+/t19-,21+,23-,27+/m0/s1
InChIKey FRXZFZIGKFKFEX-ZCZMNNNKSA-N
Mol Weight 645.9 g/mol
Molecular Formula C27H47N3O9SSi2
Exact Mass 645.257159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2V0uca2ToQ5
Name #15D;[1-[2',5'-BIS-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-RIBOFURANOSYL]-THYMINE]-3'-SPIRO-5''-(4''-AMINO-3''-(E)-(1-HYDROXY-2-PROPENYLENO)-1'',2''-OXATHIOLE-2'',2''-DIO
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H47N3O9SSi2
InChI InChI=1S/C27H47N3O9SSi2/c1-17-15-30(24(33)29-22(17)32)23-21(38-42(10,11)26(5,6)7)27(19(37-23)16-36-41(8,9)25(2,3)4)20(28)18(13-12-14-31)40(34,35)39-27/h12-13,15,19,21,23,31H,14,16,28H2,1-11H3,(H,29,32,33)/b13-12+/t19-,21+,23-,27+/m0/s1
InChIKey FRXZFZIGKFKFEX-ZCZMNNNKSA-N
Literature Reference Author E.LOBATON,F.RODRIGUEZ-BARRIOS,F.GAGO,M.J.PEREZ-PEREZ,E.D.CLE RCQ,J.BALZARINI,M.J.
Literature Reference Citation J.MED.CHEM.,45,3934(2002)
Literature Reference DOI 10.1021/jm020820h
Molecular Weight 645.916 g/mol
Sample ID 64452
Solvent ACETONE-D6
SpectraBase Batch ID LA4r2O72bEo