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5'-O-BENZOYL-2',3'-O-SULFINYLADENOSINE

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5'-O-BENZOYL-2',3'-O-SULFINYLADENOSINE
SpectraBase Compound ID HygxUt8xWCi
InChI InChI=1S/C17H16N5O6S/c18-14-11-15(20-7-19-14)22(8-21-11)16-13-12(27-29(24)28-13)10(26-16)6-25-17(23)9-4-2-1-3-5-9/h1-5,7-8,10,12-13,16,24H,6H2,(H2,18,19,20)/t10-,12-,13-,16-/m0/s1
InChIKey YQUCPNAFRKSHHZ-SDPXSBNPSA-N
Mol Weight 418.4 g/mol
Molecular Formula C17H16N5O6S
Exact Mass 418.082129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HrCqvSsgFfa
Name 5'-O-BENZOYL-2',3'-O-SULFINYLADENOSINE
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H16N5O6S
InChI InChI=1S/C17H16N5O6S/c18-14-11-15(20-7-19-14)22(8-21-11)16-13-12(27-29(24)28-13)10(26-16)6-25-17(23)9-4-2-1-3-5-9/h1-5,7-8,10,12-13,16,24H,6H2,(H2,18,19,20)/t10-,12-,13-,16-/m0/s1
InChIKey YQUCPNAFRKSHHZ-SDPXSBNPSA-N
Literature Reference Author M.J.ROBINS,F.HANSSKE,S.F.WNUK,T.KANAI
Literature Reference Citation CAN.J.CHEM.,69,1468(1991)
Literature Reference DOI 10.1139/v91-217
Molecular Weight 418.404 g/mol
Solvent Unknown
Source File Reference UWVP4856