| SpectraBase Compound ID | 6reocMvQEcg |
|---|---|
| InChI | InChI=1S/C7H7Cl6NO4/c8-6(9,10)2-17-4(15)1-14-5(16)18-3-7(11,12)13/h1-3H2,(H,14,16) |
| InChIKey | ZIKSWIXKIWSBBY-UHFFFAOYSA-N |
| Mol Weight | 381.9 g/mol |
| Molecular Formula | C7H7Cl6NO4 |
| Exact Mass | 378.850624 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ak6yOHKNwdm |
|---|---|
| Name | Glycine, N-(2,2,2-trichloroethoxy)carbonyl-, 2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 378.850623905 u |
| Formula | C7H7Cl6NO4 |
| InChI | InChI=1S/C7H7Cl6NO4/c8-6(9,10)2-17-4(15)1-14-5(16)18-3-7(11,12)13/h1-3H2,(H,14,16) |
| InChIKey | ZIKSWIXKIWSBBY-UHFFFAOYSA-N |
| Molecular Weight | 381.854 g/mol |
| SMILES | C(COC(NCC(OCC(Cl)(Cl)Cl)=O)=O)(Cl)(Cl)Cl |