3-[4-Methoxy-2-(trifluoromethyl)-6-quinolyl]prop-2-ynyl thiophene-2-carboxylate

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Systematic / IUPAC Name: 3-[4-Methoxy-2-(trifluoromethyl)-6-quinolinyl]-2-propyn-1-yl 2-thiophenecarboxylate

ID: Reference4808

Other Names: 2-Thiophenecarboxylic acid, 3-[4-methoxy-2-(trifluoromethyl)-6-quinolinyl]-2-propyn-1-yl ester

Formula: C19H12F3NO3S

Spectral Data

3-[4-Methoxy-2-(trifluoromethyl)-6-quinolyl]prop-2-ynyl thiophene-2-carboxylate 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 5/12/2016 7:34:42 AM
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Identificators

InChI InChI=1S/C19H12F3NO3S/c1-25-15-11-17(19(20,21)22)23-14-7-6-12(10-13(14)15)4-2-8-26-18(24)16-5-3-9-27-16/h3,5-7,9-11H,8H2,1H3
InChI Key CQCPXZGFXHOHAJ-UHFFFAOYSA-N
Canonical SMILES COC1=CC(=NC2=C1C=C(C=C2)C#CCOC(=O)C3=CC=CS3)C(F)(F)F
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Other Names 2-Thiophenecarboxylic acid, 3-[4-methoxy-2-(trifluoromethyl)-6-quinolinyl]-2-propyn-1-yl ester

In Other Databases

ChemSpider 2100342
PubChem 2822122