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3-Picolinium, 1-benzamido-, hydroxide, inner salt
SpectraBase Compound ID KLXN1gBUHcz
InChI InChI=1S/C13H12N2O/c1-11-6-5-9-15(10-11)14-13(16)12-7-3-2-4-8-12/h2-10H,1H3
InChIKey ATIJPTQIGLDNIQ-UHFFFAOYSA-N
Mol Weight 212.25 g/mol
Molecular Formula C13H12N2O
Exact Mass 212.094963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2JX7GcHbrjb
Name 3-Picolinium, 1-benzamido-, hydroxide, inner salt
Alternate Name(s) (Z)-N-(3-methyl-1-pyridin-1-iumyl)benzenecarboximidate (Z)-N-(3-methylpyridin-1-ium-1-yl)benzenecarboximidate N-Benzoylimino-3-methylpyridinium betaine
CAS Registry Number 31382-86-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O
InChI InChI=1S/C13H12N2O/c1-11-6-5-9-15(10-11)14-13(16)12-7-3-2-4-8-12/h2-10H,1H3
InChIKey ATIJPTQIGLDNIQ-UHFFFAOYSA-N
Molecular Weight 212.252 g/mol
SMILES Cc1ccc[n+](c1)\N=C\(c1ccccc1)[O-]
SPLASH splash10-01rf-9220000000-76e21258e6f4df9147c9
Source of Spectrum OS-5-31-0
Wiley ID 1211709