| SpectraBase Compound ID | 1rz9oduS9jk |
|---|---|
| InChI | InChI=1S/C13H24Cl3NO2/c1-3-5-6-7-8-10-17(9-4-2)12(18)19-11-13(14,15)16/h3-11H2,1-2H3 |
| InChIKey | DFUGYGXJEVBWLH-UHFFFAOYSA-N |
| Mol Weight | 332.7 g/mol |
| Molecular Formula | C13H24Cl3NO2 |
| Exact Mass | 331.087262 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CWJdx6KGHe4 |
|---|---|
| Name | Carbonic acid, monoamide, N-propyl-N-heptyl-, 2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 331.087262115 u |
| Formula | C13H24Cl3NO2 |
| InChI | InChI=1S/C13H24Cl3NO2/c1-3-5-6-7-8-10-17(9-4-2)12(18)19-11-13(14,15)16/h3-11H2,1-2H3 |
| InChIKey | DFUGYGXJEVBWLH-UHFFFAOYSA-N |
| Molecular Weight | 332.699 g/mol |
| SMILES | C(N(CCC)CCCCCCC)(=O)OCC(Cl)(Cl)Cl |