| SpectraBase Spectrum ID |
EgrJIh7qBYm |
| Name |
1-(2-Besyl-3,6-dihydroxy-phenyl)ethanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
292.040544655 u |
| Formula |
C14H12O5S |
| InChI |
InChI=1S/C14H12O5S/c1-9(15)13-11(16)7-8-12(17)14(13)20(18,19)10-5-3-2-4-6-10/h2-8,16-17H,1H3 |
| InChIKey |
PNCTUYMQMCIUTR-UHFFFAOYSA-N |
| Molecular Weight |
292.305 g/mol |
| SMILES |
C=1(C(=C(C(=CC1)O)S(=O)(=O)C=1C=CC=CC1)C(=O)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933819 |
