| SpectraBase Compound ID | 4E1wwkfwTuW |
|---|---|
| InChI | InChI=1S/C7H12N2O4/c1-5(10)8-3-6(11)9-4-7(12)13-2/h3-4H2,1-2H3,(H,8,10)(H,9,11) |
| InChIKey | JSBPKTULFDBSFS-UHFFFAOYSA-N |
| Mol Weight | 188.18 g/mol |
| Molecular Formula | C7H12N2O4 |
| Exact Mass | 188.079707 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DEVEgbmuPd1 |
|---|---|
| Name | N-Acetyl-glycyl-glycine methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.079706870 u |
| Formula | C7H12N2O4 |
| InChI | InChI=1S/C7H12N2O4/c1-5(10)8-3-6(11)9-4-7(12)13-2/h3-4H2,1-2H3,(H,8,10)(H,9,11) |
| InChIKey | JSBPKTULFDBSFS-UHFFFAOYSA-N |
| SMILES | C(CNC(CNC(=O)C)=O)(=O)OC |