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2-(BENZYLSULFANYL)-6-CHLOROPURINE

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2-(BENZYLSULFANYL)-6-CHLOROPURINE
SpectraBase Compound ID HSIlECIyo2C
InChI InChI=1S/C12H9ClN4S/c13-10-9-11(15-7-14-9)17-12(16-10)18-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,14,15,16,17)
InChIKey VBPLCCYCWKFWAJ-UHFFFAOYSA-N
Mol Weight 276.75 g/mol
Molecular Formula C12H9ClN4S
Exact Mass 276.023645 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F75kt57F3up
Name 2-(BENZYLSULFANYL)-6-CHLOROPURINE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9ClN4S
InChI InChI=1S/C12H9ClN4S/c13-10-9-11(15-7-14-9)17-12(16-10)18-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,14,15,16,17)
InChIKey VBPLCCYCWKFWAJ-UHFFFAOYSA-N
Literature Reference Author D.TADDEI,A.M.Z.SLAWIN,J.D.WOOLLINS
Literature Reference Citation EUR.J.ORG.CHEM.,939(2005)
Molecular Weight 276.743 g/mol
Sample ID 39085
Solvent DMSO-D6