| SpectraBase Spectrum ID |
Ijnsm9AnGvq |
| Name |
2-(Phenyl-1'-sulfinyl)-3,4-dimethoxyacetophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.076930165 u |
| Formula |
C16H16O4S |
| InChI |
InChI=1S/C16H16O4S/c1-19-15-9-8-12(10-16(15)20-2)14(17)11-21(18)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3 |
| InChIKey |
MLSYGRMZXFJASD-UHFFFAOYSA-N |
| Molecular Weight |
304.360 g/mol |
| SMILES |
C(S(=O)C=1C=CC=CC1)C(C=1C=C(OC)C(=CC1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.833043 |
