| SpectraBase Spectrum ID |
8OTeUyaeBfv |
| Name |
4-Bromo-2,3-dihydro-2-N-methyl-N-(prop-2-enyl)aminomethylthiophene-1,1-dioxide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
293.008512931 u |
| Formula |
C10H16BrNO2S |
| InChI |
InChI=1S/C10H16BrNO2S/c1-4-5-12(3)7-9-6-10(11)8(2)15(9,13)14/h4,6,8-9H,1,5,7H2,2-3H3 |
| InChIKey |
JPVQHZRCYKYNQG-UHFFFAOYSA-N |
| Molecular Weight |
294.207 g/mol |
| SMILES |
C1(S(C(C(=C1)Br)C)(=O)=O)CN(CC=C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942047 |
