| SpectraBase Compound ID | FzYMSN8wV0R |
|---|---|
| InChI | InChI=1S/C8H13NO3/c1-3-5-7(9-6-10)8(11)12-4-2/h3,6-7H,1,4-5H2,2H3,(H,9,10) |
| InChIKey | JNJKTVFMXYHIRX-UHFFFAOYSA-N |
| Mol Weight | 171.2 g/mol |
| Molecular Formula | C8H13NO3 |
| Exact Mass | 171.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DN92rrrlCiK |
|---|---|
| Name | 4-Pentenoic acid, 2-(formylamino)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.089543280 u |
| Formula | C8H13NO3 |
| InChI | InChI=1S/C8H13NO3/c1-3-5-7(9-6-10)8(11)12-4-2/h3,6-7H,1,4-5H2,2H3,(H,9,10) |
| InChIKey | JNJKTVFMXYHIRX-UHFFFAOYSA-N |
| Molecular Weight | 171.196 g/mol |
| SMILES | C(=O)(C(NC=O)CC=C)OCC |