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7-BENZYL-6-BENZYLTHIOPURINE

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7-BENZYL-6-BENZYLTHIOPURINE
SpectraBase Compound ID HZKq52eaxk6
InChI InChI=1S/C19H16N4S/c1-3-7-15(8-4-1)11-23-14-22-18-17(23)19(21-13-20-18)24-12-16-9-5-2-6-10-16/h1-10,13-14H,11-12H2
InChIKey WCOYVEBKBQMYQI-UHFFFAOYSA-N
Mol Weight 332.43 g/mol
Molecular Formula C19H16N4S
Exact Mass 332.109568 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E8iQnpE9PyT
Name 7-BENZYL-6-BENZYLTHIOPURINE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H16N4S
InChI InChI=1S/C19H16N4S/c1-3-7-15(8-4-1)11-23-14-22-18-17(23)19(21-13-20-18)24-12-16-9-5-2-6-10-16/h1-10,13-14H,11-12H2
InChIKey WCOYVEBKBQMYQI-UHFFFAOYSA-N
Literature Reference Author J.J.HUANG,A.RAGOUZEOS,J.L.RIDEOUT
Literature Reference Citation J.HETCYCL.CHEM.,31,1685(1994)
Literature Reference DOI 10.1002/jhet.5570310669
Molecular Weight 332.423 g/mol
Solvent DMSO-D6
Source File Reference UWCP6677