| SpectraBase Compound ID | Ege5fdVWJjc |
|---|---|
| InChI | InChI=1S/C11H17NO3/c1-3-7-12-9(5-6-10(12)13)8-11(14)15-4-2/h8H,3-7H2,1-2H3/b9-8+ |
| InChIKey | HJYMQDPPCNYWKK-CMDGGOBGSA-N |
| Mol Weight | 211.26 g/mol |
| Molecular Formula | C11H17NO3 |
| Exact Mass | 211.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3moF793CRaF |
|---|---|
| Name | (2E)-2-(5-Keto-1-propyl-pyrrolidin-2-ylidene)acetic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.120843408 u |
| Formula | C11H17NO3 |
| InChI | InChI=1S/C11H17NO3/c1-3-7-12-9(5-6-10(12)13)8-11(14)15-4-2/h8H,3-7H2,1-2H3/b9-8+ |
| InChIKey | HJYMQDPPCNYWKK-CMDGGOBGSA-N |
| Molecular Weight | 211.261 g/mol |
| SMILES | C1(N(\C(CC1)=C/C(=O)OCC)CCC)=O |