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6-CHLORO-9-(1-OXA-4-THIACYCLOHEX-2-EN-2-YL)-9H-PURINE

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6-CHLORO-9-(1-OXA-4-THIACYCLOHEX-2-EN-2-YL)-9H-PURINE
SpectraBase Compound ID 9WBeyT3oJS7
InChI InChI=1S/C9H7ClN4OS/c10-8-7-9(12-4-11-8)14(5-13-7)6-3-16-2-1-15-6/h3-5H,1-2H2
InChIKey NLARPTFJGHAFLE-UHFFFAOYSA-N
Mol Weight 254.69 g/mol
Molecular Formula C9H7ClN4OS
Exact Mass 254.00291 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HHnc4kxguZa
Name 6-CHLORO-9-(1-OXA-4-THIACYCLOHEX-2-EN-2-YL)-9H-PURINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7ClN4OS
InChI InChI=1S/C9H7ClN4OS/c10-8-7-9(12-4-11-8)14(5-13-7)6-3-16-2-1-15-6/h3-5H,1-2H2
InChIKey NLARPTFJGHAFLE-UHFFFAOYSA-N
Literature Reference Author W.A.SZAREK,B.M.PINTO,M.IWAKAWA
Literature Reference Citation CAN.J.CHEM.,63,2149(1985)
Literature Reference DOI 10.1139/v85-354
Molecular Weight 254.694 g/mol
Solvent CDCl3
Source File Reference UWED2184