5-Oxo-1-[4-(trifluoromethoxy)phenyl]pyrrolidine-3-carboxylic acid

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Systematic / IUPAC Name: 5-Oxo-1-[4-(trifluoromethoxy)phenyl]-3-pyrrolidinecarboxylic acid

ID: Reference4661

Other Names: 2-Oxo-1-(4-trifluoromethoxyphenyl)pyrrolidine-4-carboxylic acid;
3-Pyrrolidinecarboxylic acid, 5-oxo-1-[4-(trifluoromethoxy)phenyl]-

Formula: C12H10F3NO4

Spectral Data

5-Oxo-1-[4-(trifluoromethoxy)phenyl]pyrrolidine-3-carboxylic 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 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 4/26/2016 12:31:01 PM
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Identificators

InChI InChI=1S/C12H10F3NO4/c13-12(14,15)20-9-3-1-8(2-4-9)16-6-7(11(18)19)5-10(16)17/h1-4,7H,5-6H2,(H,18,19)
InChI Key XEGOMPWWQGMOQJ-UHFFFAOYSA-N
Canonical SMILES C1C(CN(C1=O)C2=CC=C(C=C2)OC(F)(F)F)C(=O)O
CAS 874765556
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Other Names 2-Oxo-1-(4-trifluoromethoxyphenyl)pyrrolidine-4-carboxylic acid;
3-Pyrrolidinecarboxylic acid, 5-oxo-1-[4-(trifluoromethoxy)phenyl]-

In Other Databases

PubChem 2741829
ChemSpider 2023385