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2-(BENZYLSULFANYL)-9-TRITYLHYPOXANTHINE

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2-(BENZYLSULFANYL)-9-TRITYLHYPOXANTHINE
SpectraBase Compound ID AYP4XcNpUIz
InChI InChI=1S/C31H24N4OS/c36-29-27-28(33-30(34-29)37-21-23-13-5-1-6-14-23)35(22-32-27)31(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,22H,21H2,(H,33,34,36)
InChIKey HYKNWTVEVQLOGC-UHFFFAOYSA-N
Mol Weight 500.62 g/mol
Molecular Formula C31H24N4OS
Exact Mass 500.167083 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FD4EPHVXgDH
Name 2-(BENZYLSULFANYL)-9-TRITYLHYPOXANTHINE
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H24N4OS
InChI InChI=1S/C31H24N4OS/c36-29-27-28(33-30(34-29)37-21-23-13-5-1-6-14-23)35(22-32-27)31(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,22H,21H2,(H,33,34,36)
InChIKey HYKNWTVEVQLOGC-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 500.618 g/mol
Sample ID 39084
Solvent DMSO-D6