Methyl isonicotinate

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Systematic / IUPAC Name: Methyl pyridine-4-carboxylate

ID: Reference3273

Other Names: 4-Carbomethoxypyridine;
4-Methoxycarbonylpyridine;
4-Picolinic acid methyl ester;
4-Pyridinecarboxylic acid, methyl ester;
Isonicotinic acid methyl ester ; more

Formula: C7H7NO2

Spectral Data

Methyl isonicotinate 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/6/2015 1:34:22 PM
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Identificators

InChI InChI=1S/C7H7NO2/c1-10-7(9)6-2-4-8-5-3-6/h2-5H,1H3
InChI Key OLXYLDUSSBULGU-UHFFFAOYSA-N
Canonical SMILES COC(=O)C1=CC=NC=C1
CAS 2459098
Splash
Other Names 4-Carbomethoxypyridine;
4-Methoxycarbonylpyridine;
4-Picolinic acid methyl ester;
4-Pyridinecarboxylic acid, methyl ester;
Isonicotinic acid methyl ester;
Methyl 4-pyridinecarboxylate;
Pyridine-4-carboxylic acid, methyl ester

In Other Databases

ChEMBL CHEMBL2251612
ChemSpider 197537
PubChem 227085