| SpectraBase Spectrum ID |
IGfbo4gaGFc |
| Name |
1H-Pyrazole, 3-benzoyl-4-bromo-1-(phenylsulfonyl)- |
| Alternate Name(s) |
4-Bromo-1-(phenylsulfonyl)pyrazol-3-yl phenyl ketone
4-Bromo-1-phenylsulphonylpyrazol-3-yl phenyl ketone
[4-bromo-1-(phenylsulfonyl)-1H-pyrazol-3-yl](phenyl)methanone |
| CAS Registry Number |
130874-33-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H11BrN2O3S |
| InChI |
InChI=1S/C16H11BrN2O3S/c17-14-11-19(23(21,22)13-9-5-2-6-10-13)18-15(14)16(20)12-7-3-1-4-8-12/h1-11H |
| InChIKey |
WITNNPJAUDIZAJ-UHFFFAOYSA-N |
| Molecular Weight |
391.239 g/mol |
| SMILES |
c1(S([n]2nc(C(=O)c3ccccc3)c(c2)Br)(=O)=O)ccccc1 |
| SPLASH |
splash10-004i-9002000000-7de743f100983f21e310 |
| Source of Spectrum |
KC-1990-1832-14 |
| Wiley ID |
1364536 |
