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3-Pyridineacetic acid
SpectraBase Compound ID LBDxSNATPV1
InChI InChI=1S/C7H7NO2/c9-7(10)4-6-2-1-3-8-5-6/h1-3,5H,4H2,(H,9,10)
InChIKey WGNUNYPERJMVRM-UHFFFAOYSA-N
Mol Weight 137.14 g/mol
Molecular Formula C7H7NO2
Exact Mass 137.047678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KhoYF5Pnqiz
Name 3-Pyridineacetic acid
CAS Registry Number 501-81-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7NO2
InChI InChI=1S/C7H7NO2/c9-7(10)4-6-2-1-3-8-5-6/h1-3,5H,4H2,(H,9,10)
InChIKey WGNUNYPERJMVRM-UHFFFAOYSA-N
Molecular Weight 137.138 g/mol
SMILES OC(=O)Cc1cccnc1
SPLASH splash10-000e-9000000000-e15726ff3b6c8fda02cb
Source of Spectrum AD-0-2647-0
Synonyms 3-Pyridinylacetic acid 2-(3-pyridinyl)acetic acid 2-(3-Pyridyl)acetic acid 2-Pyridin-3-ylacetic acid 2-Pyridin-3-ylethanoic acid 3-Pyridylacetic acid Coletin Lessterol Lioxone Minedil Piridil Piristerol Pyridin-3-ylacetic acid Pyridine-3-acetic acid Toneon EINECS 207-928-7 NSC 70769
Wiley ID 1137178