| SpectraBase Compound ID | FWVwd6uKXjg |
|---|---|
| InChI | InChI=1S/C10H18O2/c1-6-4-7(2)9(10(11)12)8(3)5-6/h6-9H,4-5H2,1-3H3,(H,11,12) |
| InChIKey | FSFCLOJEIVXNLX-UHFFFAOYSA-N |
| Mol Weight | 170.25 g/mol |
| Molecular Formula | C10H18O2 |
| Exact Mass | 170.13068 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1uMOnFzdyib |
|---|---|
| Name | Cyclohexanecarboxylic acid, 2,4,6-trimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.130679818 u |
| Formula | C10H18O2 |
| InChI | InChI=1S/C10H18O2/c1-6-4-7(2)9(10(11)12)8(3)5-6/h6-9H,4-5H2,1-3H3,(H,11,12) |
| InChIKey | FSFCLOJEIVXNLX-UHFFFAOYSA-N |
| Molecular Weight | 170.252 g/mol |
| SMILES | OC(C1C(CC(CC1C)C)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.839629 |