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1-(2-AMINO-5-CYANO-4-HYDROXY-6-PHENYL-PYRID-3-YL)-PYRIDINIUM-PERCHLORATE

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1-(2-AMINO-5-CYANO-4-HYDROXY-6-PHENYL-PYRID-3-YL)-PYRIDINIUM-PERCHLORATE
SpectraBase Compound ID Cv1iAQwOnki
InChI InChI=1S/C17H12N4O.ClHO4/c18-11-13-14(12-7-3-1-4-8-12)20-17(19)15(16(13)22)21-9-5-2-6-10-21;2-1(3,4)5/h1-10H,(H2-,19,20,22);(H,2,3,4,5)
InChIKey AWGRMMRLMTUCKV-UHFFFAOYSA-N
Mol Weight 388.77 g/mol
Molecular Formula C17H13ClN4O5
Exact Mass 388.057447 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5bvKcwKk9yW
Name 1-(2-AMINO-5-CYANO-4-HYDROXY-6-PHENYL-PYRID-3-YL)-PYRIDINIUM-PERCHLORATE
Compound Number 8C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13ClN4O5
InChI InChI=1S/C17H12N4O.ClHO4/c18-11-13-14(12-7-3-1-4-8-12)20-17(19)15(16(13)22)21-9-5-2-6-10-21;2-1(3,4)5/h1-10H,(H2-,19,20,22);(H,2,3,4,5)
InChIKey AWGRMMRLMTUCKV-UHFFFAOYSA-N
Literature Reference Author K.GEWALD,M.REHWALD,K.ECKERT,H.SCHAEFER,M.GRUNER
Literature Reference Citation MH.CHEM.,126,711(1995)
Literature Reference DOI 10.1007/BF00807162
Molecular Weight 388.767 g/mol
Solvent DMSO-D6
Source File Reference UWPB17