| SpectraBase Compound ID | D9y94ztrKZU |
|---|---|
| InChI | InChI=1S/C12H23Cl3O/c1-2-3-4-5-6-7-8-9-10-11(16)12(13,14)15/h11,16H,2-10H2,1H3 |
| InChIKey | ORBVYNQGESENMW-UHFFFAOYSA-N |
| Mol Weight | 289.67 g/mol |
| Molecular Formula | C12H23Cl3O |
| Exact Mass | 288.081448 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D6Q5rf4D7mU |
|---|---|
| Name | 1,1,1-Trichloro-2-dodecanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.081448460 u |
| Formula | C12H23Cl3O |
| InChI | InChI=1S/C12H23Cl3O/c1-2-3-4-5-6-7-8-9-10-11(16)12(13,14)15/h11,16H,2-10H2,1H3 |
| InChIKey | ORBVYNQGESENMW-UHFFFAOYSA-N |
| Molecular Weight | 289.674 g/mol |
| SMILES | C(C(O)CCCCCCCCCC)(Cl)(Cl)Cl |