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3-Pyridinecarboxylic acid
SpectraBase Compound ID GwSEeUk12pp
InChI InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
InChIKey PVNIIMVLHYAWGP-UHFFFAOYSA-N
Mol Weight 123.11 g/mol
Molecular Formula C6H5NO2
Exact Mass 123.032028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45r0IUyKxwa
Name 3-Pyridinecarboxylic acid
CAS Registry Number 59-67-6
Classification Pyridinecarboxylic acids
Comments Generally Recognized as Safe; NTIS Accession Number: PB80112030
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 123.032028403 u
Formula C6H5NO2
InChI InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
InChIKey PVNIIMVLHYAWGP-UHFFFAOYSA-N
Molecular Weight 123.111 g/mol
Number of Peaks 67
SMILES OC(c1cnccc1)=O
SPLASH splash10-0kor-9600000000-b81714fa83d239ee0eae
Source of Spectrum W-18-524-28
Synonyms 3-Carboxylpyridine 3-Carboxypyridine 3-Picolinic acid 3PYRCOOH Acide nicotinique Acido nicotinico Acidum nicotinicum Akotin anti-Pellagra vitamin Apelagrin Bionic Daskil Davitamon PP Diacin Direktan Efacin Enduracin Kyselina nikotinova LINIC Linic m-Pyridinecarboxylic acid NAH Naotin NIAC Niac Niacin Niacine Niacor Niaspan Nicacid Nicagin Nicamin Nicangin NICO NICO-400- Nico-400 Nico-Span Nicobid Nicocap Nicocidin Nicocrisina Nicodan Nicodelmine Nicodon Nicolar Niconacid Niconat Niconazid Nicorol Nicosan 3 Nicoside Nicosyl Nicotamin Nicotene Nicotil Nicotinate Nicotine acid Nicotinic acid Nicotinipca Nicotinsaure Nicovasan Nicovasen Nicovel NICYL Nicyl Nipellen Nyclin P.P. factor P.P. factor-pellagra preventive factor Pellagra Pellagra preventive factor Pellagramin Pellagrin Pelonin Peviton PP Factor Preventative factor Pyridine-.beta.-carboxylic acid Pyridine-3-carbonic acid Pyridine-3-carboxylic acid Pyridine-carboxylique-3 Pyridinecarboxylic acid, 3- S115 SK-Niacin Slo-niacin Tega-Span TINIC Vitamin B3 Vitaplex N Wampocap AI3-18994 BRN 0109591 CASWELL NO. 598 CCRIS 1902 EINECS 200-441-0 EPA PESTICIDE CHEMICAL CODE 056701 HSDB 3134 NSC 169454 SR 4390
Wiley ID 4316