| SpectraBase Spectrum ID |
8QFGwvwerWD |
| Name |
1H,3H-Thieno[3,4-F]isobenzofuran-1,3-dione, 3A,4,5,7,8,8A-hexahydro-, cis- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
210.035065353 u |
| Formula |
C10H10O3S |
| InChI |
InChI=1S/C10H10O3S/c11-9-7-1-5-3-14-4-6(5)2-8(7)10(12)13-9/h7-8H,1-4H2/t7-,8+ |
| InChIKey |
AWKADQJNGVUVHX-OCAPTIKFSA-N |
| Molecular Weight |
210.247 g/mol |
| SMILES |
C1(OC([C@]2(CC=3CSCC3C[C@@]12[H])[H])=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.985272 |
![1H,3H-Thieno[3,4-f]isobenzofuran-1,3-dione, 3a,4,5,7,8,8a-hexahydro-, cis-](/api/spectrum/8QFGwvwerWD/structure.png?h=300&w=458 "1H,3H-Thieno[3,4-f]isobenzofuran-1,3-dione, 3a,4,5,7,8,8a-hexahydro-, cis-")
