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CIS-6-CHLORO-9-(3-ACETOXY-1-OXA-4-THIACYCLOHEXAN-2-YL)-9H-PURINE
SpectraBase Compound ID E7cy5Ndy2g1
InChI InChI=1S/C11H11ClN4O3S/c1-6(17)19-11-10(18-2-3-20-11)16-5-15-7-8(12)13-4-14-9(7)16/h4-5,10-11H,2-3H2,1H3/t10-,11+/m0/s1
InChIKey IZKFRRHPJSQPCE-WDEREUQCSA-N
Mol Weight 314.75 g/mol
Molecular Formula C11H11ClN4O3S
Exact Mass 314.024039 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B1zlc26Ieng
Name CIS-6-CHLORO-9-(3-ACETOXY-1-OXA-4-THIA-CYCLOHEXAN-2-YL)-9H-PURINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H11ClN4O3S
InChI InChI=1S/C11H11ClN4O3S/c1-6(17)19-11-10(18-2-3-20-11)16-5-15-7-8(12)13-4-14-9(7)16/h4-5,10-11H,2-3H2,1H3/t10-,11+/m0/s1
InChIKey IZKFRRHPJSQPCE-WDEREUQCSA-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 314.746 g/mol
Solvent CDCl3
Source File Reference UWED1268