| SpectraBase Compound ID | HEDmzO15uf0 |
|---|---|
| InChI | InChI=1S/C10H18Cl3NO2/c1-3-4-5-6-8(2)14-9(15)16-7-10(11,12)13/h8H,3-7H2,1-2H3,(H,14,15) |
| InChIKey | BJADLBWWJYRXLG-UHFFFAOYSA-N |
| Mol Weight | 290.62 g/mol |
| Molecular Formula | C10H18Cl3NO2 |
| Exact Mass | 289.040312 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6RWRdWaNvmS |
|---|---|
| Name | Carbonic acid, monoamide, N-hept-2-yl-, 2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.040311922 u |
| Formula | C10H18Cl3NO2 |
| InChI | InChI=1S/C10H18Cl3NO2/c1-3-4-5-6-8(2)14-9(15)16-7-10(11,12)13/h8H,3-7H2,1-2H3,(H,14,15) |
| InChIKey | BJADLBWWJYRXLG-UHFFFAOYSA-N |
| Molecular Weight | 290.618 g/mol |
| SMILES | C(OCC(Cl)(Cl)Cl)(=O)NC(CCCCC)C |