| SpectraBase Compound ID | HyzIGeZWCYE |
|---|---|
| InChI | InChI=1S/C9H14Cl3NO4/c1-6(2)4-16-7(14)3-13-8(15)17-5-9(10,11)12/h6H,3-5H2,1-2H3,(H,13,15) |
| InChIKey | JTOCBJZPPORNKB-UHFFFAOYSA-N |
| Mol Weight | 306.57 g/mol |
| Molecular Formula | C9H14Cl3NO4 |
| Exact Mass | 304.998841 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3KPfoChMf48 |
|---|---|
| Name | Glycine, N-(2,2,2-trichloroethoxy)carbonyl-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.998841031 u |
| Formula | C9H14Cl3NO4 |
| InChI | InChI=1S/C9H14Cl3NO4/c1-6(2)4-16-7(14)3-13-8(15)17-5-9(10,11)12/h6H,3-5H2,1-2H3,(H,13,15) |
| InChIKey | JTOCBJZPPORNKB-UHFFFAOYSA-N |
| Molecular Weight | 306.573 g/mol |
| SMILES | CC(C)COC(=O)CNC(OCC(Cl)(Cl)Cl)=O |