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9-[2',3'-DIDEOXY-3'-C-(HYDROXYMETHYL)-4'-THIO-ALPHA-D-ERYTHRO-PENTOFURANOSYL]-ADENINE
SpectraBase Compound ID FYDtxuECCPH
InChI InChI=1S/C11H15N5O2S/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(3-18)19-8/h4-8,17-18H,1-3H2,(H2,12,13,14)/t6-,7-,8+/m0/s1
InChIKey YOLLMGKBQKIZAV-BIIVOSGPSA-N
Mol Weight 281.33 g/mol
Molecular Formula C11H15N5O2S
Exact Mass 281.094646 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ANt8DPpLFGG
Name 9-[2',3'-DIDEOXY-3'-C-(HYDROXYMETHYL)-4'-THIO-ALPHA-D-ERYTHRO-PENTOFURANOSYL]-ADENINE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H15N5O2S
InChI InChI=1S/C11H15N5O2S/c12-10-9-11(14-4-13-10)16(5-15-9)8-1-6(2-17)7(3-18)19-8/h4-8,17-18H,1-3H2,(H2,12,13,14)/t6-,7-,8+/m0/s1
InChIKey YOLLMGKBQKIZAV-BIIVOSGPSA-N
Literature Reference Author J.BRANALT,I.KVARNSTROEM,G.NIKLASSON,S.C.T.SVENSSON,B.CLASSON ,B.SAMUELSSON
Literature Reference Citation J.ORG.CHEM.,59,1785(1994)
Molecular Weight 281.332 g/mol
Solvent DMSO-D6
Source File Reference UWCP5196