| SpectraBase Spectrum ID |
AfOSDGb3knT |
| Name |
3-[1',3'-Dioxo-[1,3]dithiolan-2'-yl]-1,3-diphenylpropan-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.069736785 u |
| Formula |
C18H18O3S2 |
| InChI |
InChI=1S/C18H18O3S2/c19-17(15-9-5-2-6-10-15)13-16(14-7-3-1-4-8-14)18-22(20)11-12-23(18)21/h1-10,16,18H,11-13H2 |
| InChIKey |
DARNGVCTSVONBW-UHFFFAOYSA-N |
| Molecular Weight |
346.459 g/mol |
| SMILES |
C1(S(CCS1=O)=O)C(CC(=O)C1=CC=CC=C1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901611 |
![3-[1',3'-Dioxo-[1,3]dithiolan-2'-yl]-1,3-diphenylpropan-1-one](/api/spectrum/AfOSDGb3knT/structure.png?h=300&w=458 "3-[1',3'-Dioxo-[1,3]dithiolan-2'-yl]-1,3-diphenylpropan-1-one")
