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3-Cyclohexene-1-carboxylic acid, 6-(4-pyridylmethylaminocarbonyl)-
SpectraBase Compound ID SWmOCZPDza
InChI InChI=1S/C14H16N2O3/c17-13(16-9-10-5-7-15-8-6-10)11-3-1-2-4-12(11)14(18)19/h1-2,5-8,11-12H,3-4,9H2,(H,16,17)(H,18,19)
InChIKey WHQJJCMFRKVKNY-UHFFFAOYSA-N
Mol Weight 260.29 g/mol
Molecular Formula C14H16N2O3
Exact Mass 260.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EybQYlldMwy
Name 3-Cyclohexene-1-carboxylic acid, 6-(4-pyridylmethylaminocarbonyl)-
Alternate Name(s) 6-(4-pyridylmethylcarbamoyl)cyclohex-3-ene-1-carboxylic acid 6-(pyridin-1-ium-4-ylmethylcarbamoyl)cyclohex-3-ene-1-carboxylate 6-(pyridin-4-ylmethylcarbamoyl)cyclohex-3-ene-1-carboxylic acid 6-([(4-Pyridinylmethyl)amino]carbonyl)-3-cyclohexene-1-carboxylic acid 6-[oxo-(4-pyridin-1-iumylmethylamino)methyl]-1-cyclohex-3-enecarboxylate 6-[oxo-(pyridin-4-ylmethylamino)methyl]-1-cyclohex-3-enecarboxylic acid
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Formula C14H16N2O3
InChI InChI=1S/C14H16N2O3/c17-13(16-9-10-5-7-15-8-6-10)11-3-1-2-4-12(11)14(18)19/h1-2,5-8,11-12H,3-4,9H2,(H,16,17)(H,18,19)
InChIKey WHQJJCMFRKVKNY-UHFFFAOYSA-N
Molecular Weight 260.293 g/mol
SMILES N(C(C1C(C(O)=O)CC=CC1)=O)Cc1ccncc1
SPLASH splash10-004l-9100000000-60c3a58454acc2ac0e09
Wiley ID 1457539