| SpectraBase Spectrum ID |
DAbpxx65lIK |
| Name |
1-[(Z)-3-Chloranyl-2-methyl-prop-1-enyl]sulfonyl-4-methyl-benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.032478531 u |
| Formula |
C11H13ClO2S |
| InChI |
InChI=1S/C11H13ClO2S/c1-9-3-5-11(6-4-9)15(13,14)8-10(2)7-12/h3-6,8H,7H2,1-2H3/b10-8- |
| InChIKey |
UYKYIKLDZSAVOU-NTMALXAHSA-N |
| Molecular Weight |
244.736 g/mol |
| SMILES |
C(\C(=C/S(C=1C=CC(=CC1)C)(=O)=O)C)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.82656 |
![1-[(Z)-3-chloranyl-2-methyl-prop-1-enyl]sulfonyl-4-methyl-benzene](/api/spectrum/DAbpxx65lIK/structure.png?h=300&w=458 "1-[(Z)-3-chloranyl-2-methyl-prop-1-enyl]sulfonyl-4-methyl-benzene")
