For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(Z)-10-(Trifluoromethyl)-2,3,4,5-tetrahydrobenzo[h][1,2]thiazonine 1,1-dioxide
SpectraBase Compound ID L13YaWIMgzb
InChI InChI=1S/C12H12F3NO2S/c13-12(14,15)10-6-5-9-4-2-1-3-7-16-19(17,18)11(9)8-10/h2,4-6,8,16H,1,3,7H2/b4-2-
InChIKey OYARAFFIWDCATQ-RQOWECAXSA-N
Mol Weight 291.29 g/mol
Molecular Formula C12H12F3NO2S
Exact Mass 291.054084 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID qSHsNHn0It
Name (Z)-10-(Trifluoromethyl)-2,3,4,5-tetrahydrobenzo[h][1,2]thiazonine 1,1-dioxide
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.054084291 u
Formula C12H12F3NO2S
InChI InChI=1S/C12H12F3NO2S/c13-12(14,15)10-6-5-9-4-2-1-3-7-16-19(17,18)11(9)8-10/h2,4-6,8,16H,1,3,7H2/b4-2-
InChIKey OYARAFFIWDCATQ-RQOWECAXSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/chem.202202267
Molecular Weight 291.288 g/mol
Quality 95
Reported Formula C12H12NO2SF3
SMILES N1CCC\C=C/C2=C(S1(=O)=O)C=C(C=C2)C(F)(F)F
SPLASH splash10-004i-0950000000-dbc3ecce71999051ccae
Source of Spectrum QE-28-SM21-1g (DOI: 10.1002/chem.202202267)
Wiley ID 1902404