| SpectraBase Compound ID | 7SSxUk60VHp |
|---|---|
| InChI | InChI=1S/C14H22O3/c15-13(11-7-3-1-4-8-11)17-14(16)12-9-5-2-6-10-12/h11-12H,1-10H2 |
| InChIKey | JOHUAELJNSBTGS-UHFFFAOYSA-N |
| Mol Weight | 238.33 g/mol |
| Molecular Formula | C14H22O3 |
| Exact Mass | 238.156895 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EA0Lw9QIDu7 |
|---|---|
| Name | Cyclohexanecarboxylic acid, anhydride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.156894565 u |
| Formula | C14H22O3 |
| InChI | InChI=1S/C14H22O3/c15-13(11-7-3-1-4-8-11)17-14(16)12-9-5-2-6-10-12/h11-12H,1-10H2 |
| InChIKey | JOHUAELJNSBTGS-UHFFFAOYSA-N |
| Molecular Weight | 238.327 g/mol |
| SMILES | C1C(CCCC1)C(=O)OC(=O)C1CCCCC1 |
| Spectrum/Structure Validation Score (Raman) | 0.950966 |