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XDQOEKURUVIGLA-IZZDOVSWSA-N

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XDQOEKURUVIGLA-IZZDOVSWSA-N
SpectraBase Compound ID Jt7DIifayi4
InChI InChI=1S/C9H8ClN5S/c1-15(9-12-13-14-16-9)11-6-7-2-4-8(10)5-3-7/h2-6H,1H3/b11-6+
InChIKey XDQOEKURUVIGLA-IZZDOVSWSA-N
Mol Weight 253.71 g/mol
Molecular Formula C9H8ClN5S
Exact Mass 253.018894 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2nbiCUhmtkH
Name XDQOEKURUVIGLA-IZZDOVSWSA-N
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8ClN5S
InChI InChI=1S/C9H8ClN5S/c1-15(9-12-13-14-16-9)11-6-7-2-4-8(10)5-3-7/h2-6H,1H3/b11-6+
InChIKey XDQOEKURUVIGLA-IZZDOVSWSA-N
Literature Reference Author H.GRAUBAUM,H.SEEBOTH
Literature Reference Citation J.PRAKT.CHEM.,329,409(1987)
Literature Reference DOI 10.1002/prac.19873290306
Molecular Weight 253.709 g/mol
Solvent DMSO-D6
Source File Reference UWED9472