| SpectraBase Spectrum ID |
7OpxTTqslHB |
| Name |
1-Phenyl-3H-[1]benzothieno[2,3-C]pyran-3-one, 9,9-dioxide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.029979972 u |
| Formula |
C17H10O4S |
| InChI |
InChI=1S/C17H10O4S/c18-15-10-13-12-8-4-5-9-14(12)22(19,20)17(13)16(21-15)11-6-2-1-3-7-11/h1-10H |
| InChIKey |
OSMXOAFXTCPBSR-UHFFFAOYSA-N |
| Molecular Weight |
310.323 g/mol |
| SMILES |
C=12S(C=3C(C2=CC(OC1C=1C=CC=CC1)=O)=CC=CC3)(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953786 |
![1-Phenyl-3H-[1]benzothieno[2,3-C]pyran-3-one, 9,9-dioxide](/api/spectrum/7OpxTTqslHB/structure.png?h=300&w=458 "1-Phenyl-3H-[1]benzothieno[2,3-C]pyran-3-one, 9,9-dioxide")
