| SpectraBase Spectrum ID |
ELk9bbMaFps |
| Name |
(1S,2R,6R)-2,6-Dimethyl-cyclohex-3-enecarboxylic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
154.099379689 u |
| Formula |
C9H14O2 |
| InChI |
InChI=1S/C9H14O2/c1-6-4-3-5-7(2)8(6)9(10)11/h3-4,6-8H,5H2,1-2H3,(H,10,11)/t6-,7-,8-/m1/s1 |
| InChIKey |
UCVWSOAZIDUTMJ-BWZBUEFSSA-N |
| Molecular Weight |
154.209 g/mol |
| SMILES |
C([C@@]1([C@@](C=CC[C@]1(C)[H])(C)[H])[H])(=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938813 |
