(10R,10aR)-10-bromo-4-(trifluoromethyl)-8,9,10,10a-tetrahydro-7H-benzo[4,5]isothiazolo[2,3-a]pyridine 5,5-dioxide
Compound with spectra: 1 MS (GC)
![(10R,10aR)-10-bromo-4-(trifluoromethyl)-8,9,10,10a-tetrahydro-7H-benzo[4,5]isothiazolo[2,3-a]pyridine 5,5-dioxide](/api/compound/3Kop1iBTIFt.png?ph=true&h=300&w=458 "(10R,10aR)-10-bromo-4-(trifluoromethyl)-8,9,10,10a-tetrahydro-7H-benzo[4,5]isothiazolo[2,3-a]pyridine 5,5-dioxide")
| SpectraBase Compound ID | 3Kop1iBTIFt |
|---|---|
| InChI | InChI=1S/C12H13BrF3NO2S/c13-9-5-2-6-17-10(9)7-3-1-4-8(12(14,15)16)11(7)20(17,18)19/h1,3-4,7,9-11H,2,5-6H2/t7?,9-,10-,11?/m1/s1 |
| InChIKey | BMYMMFVQXQDDIR-JWKLSDCMSA-N |
| Mol Weight | 372.2 g/mol |
| Molecular Formula | C12H13BrF3NO2S |
| Exact Mass | 370.980247 g/mol |
| Enantiomer InChIKey | BMYMMFVQXQDDIR-UPACWWRESA-N |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | QE-28-SM31-2h' (DOI: 10.1002/chem.202202267) |