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TRANS-6-CHLORO-9-(1-OXA-4-OXO-4-THIACYCLOHEXAN-3-YL)-9H-PURINE

View entire compound with spectra: 4 NMR

TRANS-6-CHLORO-9-(1-OXA-4-OXO-4-THIACYCLOHEXAN-3-YL)-9H-PURINE
SpectraBase Compound ID EoWcqNmPZpK
InChI InChI=1S/C9H9ClN4O2S/c10-8-7-9(12-4-11-8)14(5-13-7)6-3-16-1-2-17(6)15/h4-6H,1-3H2/t6-,17?/m1/s1
InChIKey JFRMZWVPXZVQPR-NJSPRXFOSA-N
Mol Weight 272.71 g/mol
Molecular Formula C9H9ClN4O2S
Exact Mass 272.013474 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CxLiXKAi0wV
Name TRANS-6-CHLORO-9-(1-OXA-4-OXO-4-THIACYCLOHEXAN-3-YL)-9H-PURINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9ClN4O2S
InChI InChI=1S/C9H9ClN4O2S/c10-8-7-9(12-4-11-8)14(5-13-7)6-3-16-1-2-17(6)15/h4-6H,1-3H2/t6-,17?/m1/s1
InChIKey JFRMZWVPXZVQPR-NJSPRXFOSA-N
Literature Reference Author W.A.SZAREK,B.M.PINTO,M.IWAKAWA
Literature Reference Citation CAN.J.CHEM.,63,2162(1985)
Literature Reference DOI 10.1139/v85-355
Molecular Weight 272.709 g/mol
Solvent DMSO-D6
Source File Reference UWED1266