Ethyl 3,3,3-trifluoro-2-hydroxy-2-[(3-pyridylcarbonyl)amino]propanoate

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Systematic / IUPAC Name: Ethyl 3,3,3-trifluoro-2-hydroxy-N-(3-pyridinylcarbonyl)alaninate

ID: Reference3905

Other Names: Alanine, 3,3,3-trifluoro-2-hydroxy-N-(3-pyridinylcarbonyl), ethyl ester;
Ethyl 3,3,3-trifluoro-2-hydroxy-N-(pyridin-3-ylcarbonyl)alaninate;
Ethyl 3,3,3-trifluoro-2-hydroxy-2-nicotinamidopropionate

Formula: C11H11F3N2O4

Spectral Data

Ethyl 3,3,3-trifluoro-2-hydroxy-2-[(3-pyridylcarbonyl)amino]propanoate 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 2
No. of Spectra 237
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/17/2016 1:26:53 PM
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Identificators

InChI InChI=1S/C11H11F3N2O4/c1-2-20-9(18)10(19,11(12,13)14)16-8(17)7-4-3-5-15-6-7/h3-6,19H,2H2,1H3,(H,16,17)
InChI Key XLSNZNXIGXZYRF-UHFFFAOYSA-N
Canonical SMILES CCOC(=O)C(C(F)(F)F)(NC(=O)C1=CN=CC=C1)O
CAS
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Other Names Alanine, 3,3,3-trifluoro-2-hydroxy-N-(3-pyridinylcarbonyl), ethyl ester;
Ethyl 3,3,3-trifluoro-2-hydroxy-N-(pyridin-3-ylcarbonyl)alaninate;
Ethyl 3,3,3-trifluoro-2-hydroxy-2-nicotinamidopropionate

In Other Databases

ChemSpider 496968
ChEMBL CHEMBL1502445
PubChem 571582