| SpectraBase Spectrum ID |
6e4sMgfUY3R |
| Name |
Cyclopentanecarboxylic acid, 3-neopentylidene-, methyl ester |
| 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/c1-12(2,3)8-9-5-6-10(7-9)11(13)14-4/h8,10H,5-7H2,1-4H3/b9-8- |
| InChIKey |
YZZNFLMAESZTDP-HJWRWDBZSA-N |
| Molecular Weight |
196.290 g/mol |
| SMILES |
CC(C)(\C=C\1CCC(C1)C(OC)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948091 |
