SpectraBase Spectrum ID |
EkvuGi9l2JA |
Name |
2H-[1]Benzothieno[3,2-B]pyran-2-one, 4-phenyl-, 5,5-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(11-6-2-1-3-7-11)17-16(21-15)12-8-4-5-9-14(12)22(17,19)20/h1-10H |
InChIKey |
JSUCGNDXJTZTQT-UHFFFAOYSA-N |
Molecular Weight |
310.323 g/mol |
SMILES |
C1=2S(C=3C(C2OC(C=C1C=1C=CC=CC1)=O)=CC=CC3)(=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960583 |