| SpectraBase Spectrum ID |
HkSH4qbLGsA |
| Name |
[(Z)-2-Ethoxy-1-phenylethenyl]sulfonylbenzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
288.082015546 u |
| Formula |
C16H16O3S |
| InChI |
InChI=1S/C16H16O3S/c1-2-19-13-16(14-9-5-3-6-10-14)20(17,18)15-11-7-4-8-12-15/h3-13H,2H2,1H3/b16-13- |
| InChIKey |
VRHSMBJMMCVSCS-SSZFMOIBSA-N |
| SMILES |
C1(\C(=C\OCC)S(C2=CC=CC=C2)(=O)=O)=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895333 |