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ALPHA-PHENYL-ALPHA-(6-CHLOROPYRIDAZIN-3-YL)-ACETONITRILE
SpectraBase Compound ID HnnNVB2QMLR
InChI InChI=1S/C12H8ClN3/c13-12-7-6-11(15-16-12)10(8-14)9-4-2-1-3-5-9/h1-7,10H
InChIKey AVFQUMVXIBTANI-UHFFFAOYSA-N
Mol Weight 229.67 g/mol
Molecular Formula C12H8ClN3
Exact Mass 229.040675 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5p7nQSuLUAH
Name ALPHA-PHENYL-ALPHA-(6-CHLOROPYRIDAZIN-3-YL)-ACETONITRILE
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H8ClN3
InChI InChI=1S/C12H8ClN3/c13-12-7-6-11(15-16-12)10(8-14)9-4-2-1-3-5-9/h1-7,10H
InChIKey AVFQUMVXIBTANI-UHFFFAOYSA-N
Literature Reference Author F.HEROLD,M.KALUCKA,M.KROL,J.HEROLD,J.KLEPS,J.TURLO
Literature Reference Citation MOLECULES,12,2643(2007)
Literature Reference DOI 10.3390/12122643
Molecular Weight 229.669 g/mol
Sample ID 57520
Solvent CDCl3