| SpectraBase Spectrum ID |
4CWCqgmyC1Q |
| Name |
1-((3-Bromo-3-methylbutyl)sulfonyl)-4-methylbenzene |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.013263959 u |
| Formula |
C12H17BrO2S |
| InChI |
InChI=1S/C12H17BrO2S/c1-10-4-6-11(7-5-10)16(14,15)9-8-12(2,3)13/h4-7H,8-9H2,1-3H3 |
| InChIKey |
AQQQMSLSEYSWFL-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201708197 |
| Molecular Weight |
305.230 g/mol |
| Quality |
205 |
| Reported Formula |
C12H17O2SBr |
| SMILES |
C(C(Br)(C)C)CS(C1=CC=C(C=C1)C)(=O)=O |
| SPLASH |
splash10-0aor-7900000000-ad335b118700b5a84ea7 |
| Source of Spectrum |
ACI-56-SM7-Br-1l (DOI: 10.1002/anie.201708197) |
| Wiley ID |
1896581 |
