| SpectraBase Spectrum ID |
8OfEYZ0OSyG |
| Name |
(3ar,3br,6as,6br)-Octahydro-5-oxa-1-thia-cyclobutadicyclopentene 1,1-dioxide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
188.050715417 u |
| Formula |
C8H12O3S |
| InChI |
InChI=1S/C8H12O3S/c9-12(10)2-1-5-6-3-11-4-7(6)8(5)12/h5-8H,1-4H2/t5-,6-,7-,8-/m1/s1 |
| InChIKey |
PJLSTBXOKBQCFB-WCTZXXKLSA-N |
| Molecular Weight |
188.241 g/mol |
| SMILES |
[C@]12(S(CC[C@@]1([C@]1(COC[C@@]21[H])[H])[H])(=O)=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887954 |
