| SpectraBase Spectrum ID |
3lQdOxmy5hH |
| Name |
Dimethyl 4,6,6-trimethylcyclohex-3-ene-1,1-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
240.136159120 u |
| Formula |
C13H20O4 |
| InChI |
InChI=1S/C13H20O4/c1-9-6-7-13(10(14)16-4,11(15)17-5)12(2,3)8-9/h6H,7-8H2,1-5H3 |
| InChIKey |
ZKSUFFOPWIYFSG-UHFFFAOYSA-N |
| Molecular Weight |
240.299 g/mol |
| SMILES |
C1(C(CC(=CC1)C)(C)C)(C(=O)OC)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922581 |
