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4-(3'-Chlorophenyl)-3-nicotinic acid

View entire compound with spectra: 1 MS (GC)

4-(3'-Chlorophenyl)-3-nicotinic acid
SpectraBase Compound ID CPGmF2SbKqB
InChI InChI=1S/C12H8ClNO2/c13-9-3-1-2-8(6-9)10-4-5-14-7-11(10)12(15)16/h1-7H,(H,15,16)
InChIKey YDDBDHXEFPKRKK-UHFFFAOYSA-N
Mol Weight 233.65 g/mol
Molecular Formula C12H8ClNO2
Exact Mass 233.024356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57M4PumxipP
Name 4-(3'-Chlorophenyl)-3-nicotinic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8ClNO2
InChI InChI=1S/C12H8ClNO2/c13-9-3-1-2-8(6-9)10-4-5-14-7-11(10)12(15)16/h1-7H,(H,15,16)
InChIKey YDDBDHXEFPKRKK-UHFFFAOYSA-N
Molecular Weight 233.654 g/mol
SMILES OC(c1c(-c2cc(Cl)ccc2)ccnc1)=O
SPLASH splash10-00m0-0190000000-700a0aa50236a95d8648
Source of Spectrum QA-39-175-4
Synonyms 4-(3-Chlorophenyl)-3-pyridinecarboxylic acid 4-(3-Chlorophenyl)pyridine-3-carboxylic acid
Wiley ID 861412