3-[3,5-Bis(trifluoromethyl)styryl]-5-{[(4-chlorophenyl)sulfonyl]methyl}-1,2,4-oxadiazole

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Systematic / IUPAC Name: 3-{(E)-2-[3,5-Bis(trifluoromethyl)phenyl]vinyl}-5-{[(4-chlorophenyl)sulfonyl]methyl}-1,2,4-oxadiazole

ID: Reference5592

Other Names: 1,2,4-Oxadiazole, 3-{(E)-2-[3,5-bis(trifluoromethyl)phenyl]ethenyl}-5-{[(4-chlorophenyl)sulfonyl]methyl}- ;
3-{(E)-2-[3,5-Bis(trifluoromethyl)phenyl]ethenyl}-5-[(4-chlorophenyl)sulfonylmethyl]-1,2,4-oxadiazole

Formula: C19H11ClF6N2O3S

Spectral Data

3-[3,5-Bis(trifluoromethyl)styryl]-5-{[(4-chlorophenyl)sulfonyl]methyl}-1,2,4-oxadiazole 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 9/12/2016 2:05:36 PM
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Identificators

InChI InChI=1S/C19H11ClF6N2O3S/c20-14-2-4-15(5-3-14)32(29,30)10-17-27-16(28-31-17)6-1-11-7-12(18(21,22)23)9-13(8-11)19(24,25)26/h1-9H,10H2/b6-1+
InChI Key RVJHUDUZTQETFM-LZCJLJQNSA-N
Canonical SMILES C1=CC(=CC=C1S(=O)(=O)CC2=NC(=NO2)C=CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)Cl
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Other Names 1,2,4-Oxadiazole, 3-{(E)-2-[3,5-bis(trifluoromethyl)phenyl]ethenyl}-5-{[(4-chlorophenyl)sulfonyl]methyl}- ;
3-{(E)-2-[3,5-Bis(trifluoromethyl)phenyl]ethenyl}-5-[(4-chlorophenyl)sulfonylmethyl]-1,2,4-oxadiazole

In Other Databases

PubChem 5713740
ChemSpider 4651384