| SpectraBase Spectrum ID |
2bR1pj0nE03 |
| Name |
Cyclopentanecarboxylic acid, 2,4-dimethyl-3-methylene-, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
168.115029753 u |
| Formula |
C10H16O2 |
| InChI |
InChI=1S/C10H16O2/c1-6-5-9(10(11)12-4)8(3)7(6)2/h6,8-9H,2,5H2,1,3-4H3 |
| InChIKey |
IBFJJYIWWYAUAN-UHFFFAOYSA-N |
| Molecular Weight |
168.236 g/mol |
| SMILES |
CC1C(=C)C(C)CC1C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972182 |
