| SpectraBase Spectrum ID |
6O4VSop7tzR |
| Name |
Cyclobutanecarboxylic acid, 3,3-dimethyl-2-(2-methyl-1-propenyl)-, methyl ester, cis-(.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
196.146329882 u |
| Formula |
C12H20O2 |
| InChI |
InChI=1S/C12H20O2/c1-8(2)6-10-9(11(13)14-5)7-12(10,3)4/h6,9-10H,7H2,1-5H3/t9-,10-/m1/s1 |
| InChIKey |
WZTOHKLGEAUFMY-NXEZZACHSA-N |
| Molecular Weight |
196.290 g/mol |
| SMILES |
[C@@]1([C@](C(=O)OC)(CC1(C)C)[H])(C=C(C)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919805 |
