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1-(5-O-BENZOYL-2,3-DIDEOXY-3-MERCAPTO-ALPHA-D-ERYTHRO-PENTAFURANOSYL)-THYMINE
SpectraBase Compound ID 6ChY8YLGPRr
InChI InChI=1S/C17H18N2O5S/c1-10-8-19(17(22)18-15(10)20)14-7-13(25)12(24-14)9-23-16(21)11-5-3-2-4-6-11/h2-6,8,12-14,25H,7,9H2,1H3,(H,18,20,22)/t12-,13+,14+/m1/s1
InChIKey XKZBTZSJLNBPEY-RDBSUJKOSA-N
Mol Weight 362.4 g/mol
Molecular Formula C17H18N2O5S
Exact Mass 362.093643 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JwB9eCwhRnc
Name 1-(5-O-BENZOYL-2,3-DIDEOXY-3-MERCAPTO-ALPHA-D-ERYTHRO-PENTAFURANOSYL)-THYMINE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18N2O5S
InChI InChI=1S/C17H18N2O5S/c1-10-8-19(17(22)18-15(10)20)14-7-13(25)12(24-14)9-23-16(21)11-5-3-2-4-6-11/h2-6,8,12-14,25H,7,9H2,1H3,(H,18,20,22)/t12-,13+,14+/m1/s1
InChIKey XKZBTZSJLNBPEY-RDBSUJKOSA-N
Literature Reference Author A.A.EL-BARBARY,A.I.KHODAIR,E.B.PEDERSEN,C.NIELSEN
Literature Reference Citation MH.CHEM.,125,1017(1994)
Literature Reference DOI 10.1007/BF00812717
Molecular Weight 362.400 g/mol
Solvent CDCl3
Source File Reference UWPR1959