| SpectraBase Compound ID | 7MzqaNFKJiY |
|---|---|
| InChI | InChI=1S/C9H13NO3/c1-3-13-9(12)6-7-4-5-8(11)10(7)2/h6H,3-5H2,1-2H3/b7-6+ |
| InChIKey | XLBDCNKWOADALG-VOTSOKGWSA-N |
| Mol Weight | 183.21 g/mol |
| Molecular Formula | C9H13NO3 |
| Exact Mass | 183.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gl0taMlCcrU |
|---|---|
| Name | (2E)-2-(1-Methyl-5-oxo-2-pyrrolidinylidene)acetic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.089543280 u |
| Formula | C9H13NO3 |
| InChI | InChI=1S/C9H13NO3/c1-3-13-9(12)6-7-4-5-8(11)10(7)2/h6H,3-5H2,1-2H3/b7-6+ |
| InChIKey | XLBDCNKWOADALG-VOTSOKGWSA-N |
| Molecular Weight | 183.207 g/mol |
| SMILES | C1(N(\C(CC1)=C/C(=O)OCC)C)=O |