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5'-O-(Acetyl)-2',3'-O-sulfonyladenosine

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5'-O-(Acetyl)-2',3'-O-sulfonyladenosine
SpectraBase Compound ID F7XKWjBSPIZ
InChI InChI=1S/C12H13N5O7S/c1-5(18)21-2-6-8-9(24-25(19,20)23-8)12(22-6)17-4-16-7-10(13)14-3-15-11(7)17/h3-4,6,8-9,12H,2H2,1H3,(H2,13,14,15)/t6-,8-,9-,12-/m0/s1
InChIKey TZVZANPXLJXVID-GTBBIVDNSA-N
Mol Weight 371.32 g/mol
Molecular Formula C12H13N5O7S
Exact Mass 371.053569 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JK3kaY8PcJ7
Name 5'-O-ACETYL-2',3'-O-SULFONYLADENOSINE
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13N5O7S
InChI InChI=1S/C12H13N5O7S/c1-5(18)21-2-6-8-9(24-25(19,20)23-8)12(22-6)17-4-16-7-10(13)14-3-15-11(7)17/h3-4,6,8-9,12H,2H2,1H3,(H2,13,14,15)/t6-,8-,9-,12-/m0/s1
InChIKey TZVZANPXLJXVID-GTBBIVDNSA-N
Literature Reference Author M.J.ROBINS,E.LEWANDOWSKA,S.F.WNUK
Literature Reference Citation J.ORG.CHEM.,63,7375(1998)
Literature Reference DOI 10.1021/jo981013m
Molecular Weight 371.325 g/mol
Sample ID 26740
Solvent DMSO-D6