2-Methyl-4-phenyl-5-pyrimidinecarboxylic acid

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Systematic / IUPAC Name: 2-Methyl-4-phenyl-5-pyrimidinecarboxylic acid

ID: Reference3548

Other Names: 2-Methyl-4-phenylpyrimidine-5-carboxylic acid;
5-Pyrimidinecarboxylicacid, 2-methyl-4-phenyl-

Formula: C12H10N2O2

Spectral Data

2-Methyl-4-phenyl-5-pyrimidinecarboxylic 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 Orbitrap Elite; Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 866
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI; NSI
Analyzers IT; FT
Last Modification 1/12/2016 11:34:34 AM
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Identificators

InChI InChI=1S/C12H10N2O2/c1-8-13-7-10(12(15)16)11(14-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,15,16)
InChI Key XKJAQESOTNACHT-UHFFFAOYSA-N
Canonical SMILES CC1=NC=C(C(=N1)C2=CC=CC=C2)C(=O)O
CAS
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Other Names 2-Methyl-4-phenylpyrimidine-5-carboxylic acid;
5-Pyrimidinecarboxylicacid, 2-methyl-4-phenyl-

In Other Databases

ChemSpider 2056824
PubChem 2776510