| SpectraBase Spectrum ID |
3w07hIVCT29 |
| Name |
trans-7-(4-Bromo-benzoyl)-6,7-dihydro-1-me-3-methylthio-6-(4-tolyl)-5H-1,2,4-triazolo(3,4-B)(1,3,4)thiadiazinium cation |
| Comments |
bromide |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C20H20BrN4OS2 |
| InChI |
InChI=1S/C20H20BrN4OS2/c1-12-4-6-13(7-5-12)16-18(17(26)14-8-10-15(21)11-9-14)28-20-24(2)23-19(27-3)25(20)22-16/h4-11,16,18,22H,1-3H3/q+1 |
| InChIKey |
DOWOIPCXXSAQNQ-UHFFFAOYSA-N |
| Instrument Name |
Varian XL-300 |
| Literature Reference |
P. Molina, M. Alajarin, M.J. De Vega, J. Chem. Soc. Perkin I 1853 (1987). |
| NMR Standard |
not reported |
| Origin |
Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent |
CDCl3 |
