| SpectraBase Compound ID | JFhgLIWAiFQ |
|---|---|
| InChI | InChI=1S/C10H17ClO2/c1-7-3-8(2)5-9(4-7)13-10(12)6-11/h7-9H,3-6H2,1-2H3 |
| InChIKey | IHIMNMLMPPWHJJ-UHFFFAOYSA-N |
| Mol Weight | 204.7 g/mol |
| Molecular Formula | C10H17ClO2 |
| Exact Mass | 204.091707 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BEmYbmSh34H |
|---|---|
| Name | Chloroacetic acid, 3,5-dimethylcyclohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.091707485 u |
| Formula | C10H17ClO2 |
| InChI | InChI=1S/C10H17ClO2/c1-7-3-8(2)5-9(4-7)13-10(12)6-11/h7-9H,3-6H2,1-2H3 |
| InChIKey | IHIMNMLMPPWHJJ-UHFFFAOYSA-N |
| Molecular Weight | 204.697 g/mol |
| SMILES | CC1CC(C)CC(C1)OC(=O)CCl |