| SpectraBase Compound ID | 6ZtGYdPnAch |
|---|---|
| InChI | InChI=1S/C8H14Cl3NO2/c1-2-3-4-5-12-7(13)14-6-8(9,10)11/h2-6H2,1H3,(H,12,13) |
| InChIKey | LYPCTPJPYMBAGF-UHFFFAOYSA-N |
| Mol Weight | 262.56 g/mol |
| Molecular Formula | C8H14Cl3NO2 |
| Exact Mass | 261.009012 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5SdO0GnTfAE |
|---|---|
| Name | Carbonic acid, monoamide, N-pentyl-, 2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.009011793 u |
| Formula | C8H14Cl3NO2 |
| InChI | InChI=1S/C8H14Cl3NO2/c1-2-3-4-5-12-7(13)14-6-8(9,10)11/h2-6H2,1H3,(H,12,13) |
| InChIKey | LYPCTPJPYMBAGF-UHFFFAOYSA-N |
| Molecular Weight | 262.564 g/mol |
| SMILES | C(OCC(Cl)(Cl)Cl)(=O)NCCCCC |