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6-[2-(METHYLSULFANYL)-ETHYL]-9H-PURINE

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6-[2-(METHYLSULFANYL)-ETHYL]-9H-PURINE
SpectraBase Compound ID CCqyIktXopN
InChI InChI=1S/C8H10N4S/c1-13-3-2-6-7-8(11-4-9-6)12-5-10-7/h4-5H,2-3H2,1H3,(H,9,10,11,12)
InChIKey XYSWGMAFEZNBCV-UHFFFAOYSA-N
Mol Weight 194.26 g/mol
Molecular Formula C8H10N4S
Exact Mass 194.062618 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CpLTwkP4sny
Name 6-[2-(METHYLSULFANYL)-ETHYL]-9H-PURINE
Compound Number 18D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H10N4S
InChI InChI=1S/C8H10N4S/c1-13-3-2-6-7-8(11-4-9-6)12-5-10-7/h4-5H,2-3H2,1H3,(H,9,10,11,12)
InChIKey XYSWGMAFEZNBCV-UHFFFAOYSA-N
Literature Reference Author M.KUCHAR,R.POHL,I.VOTRUBA,M.HOCEK
Literature Reference Citation EUR.J.ORG.CHEM.,5083(2006)
Molecular Weight 194.254 g/mol
Sample ID 33036
Solvent DMSO-D6