| SpectraBase Spectrum ID |
F8VkB9olxvC |
| Name |
5,9,9-Trimethyl-1-thia-8,10-dioxaspiro[5.5]undec-3-en-7,11-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.061280101 u |
| Formula |
C11H14O4S |
| InChI |
InChI=1S/C11H14O4S/c1-7-5-4-6-16-11(7)8(12)14-10(2,3)15-9(11)13/h4-5,7H,6H2,1-3H3 |
| InChIKey |
VKQRUWMFAGEKRY-UHFFFAOYSA-N |
| Molecular Weight |
242.289 g/mol |
| SMILES |
C12(C(OC(OC2=O)(C)C)=O)SCC=CC1C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94478 |
![5,9,9-Trimethyl-1-thia-8,10-dioxaspiro[5.5]undec-3-en-7,11-dione](/api/spectrum/F8VkB9olxvC/structure.png?h=300&w=458 "5,9,9-Trimethyl-1-thia-8,10-dioxaspiro[5.5]undec-3-en-7,11-dione")
