N1-(2-Oxotetrahydrothiophen-3-yl)-3,5-bis(trifluoromethyl)benzene-1-sulfonamide

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Systematic / IUPAC Name: N-(2-Oxotetrahydro-3-thiophenyl)-3,5-bis(trifluoromethyl)benzenesulfonamide

ID: Reference3701

Other Names: Benzenesulfonamide, N-(tetrahydro-2-oxo-3-thienyl)-3,5-bis(trifluoromethyl)-

Formula: C12H9F6NO3S2

Spectral Data

N1-(2-Oxotetrahydrothiophen-3-yl)-3,5-bis(trifluoromethyl)benzene-1-sulfonamide 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 2/4/2016 9:32:16 AM
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Identificators

InChI InChI=1S/C12H9F6NO3S2/c13-11(14,15)6-3-7(12(16,17)18)5-8(4-6)24(21,22)19-9-1-2-23-10(9)20/h3-5,9,19H,1-2H2
InChI Key WBQMJLJRZMTSBC-UHFFFAOYSA-N
Canonical SMILES C1CSC(=O)C1NS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F
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Other Names Benzenesulfonamide, N-(tetrahydro-2-oxo-3-thienyl)-3,5-bis(trifluoromethyl)-

In Other Databases

ChemSpider 2098567
PubChem 2820338