3-(Dimethylamino)-1-{3-[3-(trifluoromethyl)phenyl]-5-isoxazolyl}-2-propen-1-one

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Systematic / IUPAC Name: (2E)-3-(Dimethylamino)-1-{3-[3-(trifluoromethyl)phenyl]-1,2-oxazol-5-yl}-2-propen-1-one

ID: Reference4349

Other Names: 2-Propen-1-one, 3-(dimethylamino)-1-{3-[3-(trifluoromethyl)phenyl]-5-isoxazolyl}-, (2E)-

Formula: C15H13F3N2O2

Spectral Data

3-(Dimethylamino)-1-{3-[3-(trifluoromethyl)phenyl]-5-isoxazolyl}-2-propen-1-one 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 3/23/2016 9:47:05 AM
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Identificators

InChI InChI=1S/C15H13F3N2O2/c1-20(2)7-6-13(21)14-9-12(19-22-14)10-4-3-5-11(8-10)15(16,17)18/h3-9H,1-2H3/b7-6+
InChI Key MVDWGLOOMGDYNK-VOTSOKGWSA-N
Canonical SMILES CN(C)C=CC(=O)C1=CC(=NO1)C2=CC(=CC=C2)C(F)(F)F
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Other Names 2-Propen-1-one, 3-(dimethylamino)-1-{3-[3-(trifluoromethyl)phenyl]-5-isoxazolyl}-, (2E)-

In Other Databases

ChemSpider 4644136
PubChem 5704221