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6-CHLORO-4-METHYL-2-(METHYLAMINO)NICOTINONITRILE
SpectraBase Compound ID 5OwLAwawrOM
InChI InChI=1S/C8H8ClN3/c1-5-3-7(9)12-8(11-2)6(5)4-10/h3H,1-2H3,(H,11,12)
InChIKey MXQUGEXJUAYHFE-UHFFFAOYSA-N
Mol Weight 181.63 g/mol
Molecular Formula C8H8ClN3
Exact Mass 181.040675 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KxWp69rLHKq
Name 6-CHLORO-4-METHYL-2-(METHYLAMINO)NICOTINONITRILE
Source of Sample G. Krack, T. Schlueter BASF Ludwigshafen (1982)
CAS Registry Number 52983-06-9
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8ClN3
InChI InChI=1S/C8H8ClN3/c1-5-3-7(9)12-8(11-2)6(5)4-10/h3H,1-2H3,(H,11,12)
InChIKey MXQUGEXJUAYHFE-UHFFFAOYSA-N
Molecular Weight 181.63
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WP-80
Synonyms NICOTINONITRILE, 6-CHLORO-4-METHYL- 2-/METHYLAMINO/-,