| SpectraBase Compound ID | K61V1ThT6DB |
|---|---|
| InChI | InChI=1S/C7H12ClNO4/c1-2-12-6(10)5-9-7(11)13-4-3-8/h2-5H2,1H3,(H,9,11) |
| InChIKey | YKMMRULCOWQWFA-UHFFFAOYSA-N |
| Mol Weight | 209.63 g/mol |
| Molecular Formula | C7H12ClNO4 |
| Exact Mass | 209.045486 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lae10VPoyWH |
|---|---|
| Name | Glycine, N-(2-chloroethoxycarbonyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.045485566 u |
| Formula | C7H12ClNO4 |
| InChI | InChI=1S/C7H12ClNO4/c1-2-12-6(10)5-9-7(11)13-4-3-8/h2-5H2,1H3,(H,9,11) |
| InChIKey | YKMMRULCOWQWFA-UHFFFAOYSA-N |
| Molecular Weight | 209.629 g/mol |
| SMILES | CCOC(=O)CNC(OCCCl)=O |