| SpectraBase Spectrum ID |
Jsw9YHQS4LB |
| Name |
Thiirane, 2,3-bis(1,1-dimethylethyl)-, 1,1-dioxide, trans- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.118401056 u |
| Formula |
C10H20O2S |
| InChI |
InChI=1S/C10H20O2S/c1-9(2,3)7-8(10(4,5)6)13(7,11)12/h7-8H,1-6H3/t7-,8-/m0/s1 |
| InChIKey |
CKZNBLBLDSKBBZ-YUMQZZPRSA-N |
| Molecular Weight |
204.328 g/mol |
| SMILES |
[C@]1(S([C@@]1(C(C)(C)C)[H])(=O)=O)(C(C)(C)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933707 |
