| SpectraBase Spectrum ID |
5vCdagt5vyT |
| Name |
Ethyl 4,4,6,6-tetramethyl-5-oxo-1-thiaspiro[2.3]hexane-2-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.097665611 u |
| Formula |
C12H18O3S |
| InChI |
InChI=1S/C12H18O3S/c1-6-15-8(13)7-12(16-7)10(2,3)9(14)11(12,4)5/h7H,6H2,1-5H3 |
| InChIKey |
IOZULOVBHAXIJM-UHFFFAOYSA-N |
| Molecular Weight |
242.333 g/mol |
| SMILES |
C1(SC11C(C(C1(C)C)=O)(C)C)C(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912873 |
![Ethyl 4,4,6,6-tetramethyl-5-oxo-1-thiaspiro[2.3]hexane-2-carboxylate](/api/spectrum/5vCdagt5vyT/structure.png?h=300&w=458 "Ethyl 4,4,6,6-tetramethyl-5-oxo-1-thiaspiro[2.3]hexane-2-carboxylate")
