2-(5-Bromo-3-pyridyl)acetic acid

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Systematic / IUPAC Name: 2-(5-Bromopyridin-3-yl)acetic acid

ID: Reference8712

Other Names: (5-Bromo-3-pyridinyl)acetic acid;
(5-Bromopyridin-3-yl)acetic acid;
3-Pyridineacetic acid, 5-bromo-;
5-Bromo-3-pyridineacetic acid;
5-Bromo-3-pyridylacetic acid

Formula: C7H6BrNO2

Spectral Data

2-(5-Bromo-3-pyridyl)acetic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 110
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/8/2019 11:43:27 AM
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Identificators

InChI InChI=1S/C7H6BrNO2/c8-6-1-5(2-7(10)11)3-9-4-6/h1,3-4H,2H2,(H,10,11)
InChI Key UETIDNDXXGCJCE-UHFFFAOYSA-N
Canonical SMILES C1=C(C=NC=C1Br)CC(=O)O
CAS 39891128
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Other Names (5-Bromo-3-pyridinyl)acetic acid;
(5-Bromopyridin-3-yl)acetic acid;
3-Pyridineacetic acid, 5-bromo-;
5-Bromo-3-pyridineacetic acid;
5-Bromo-3-pyridylacetic acid

In Other Databases

ChemSpider 2081215
PubChem 2802539