![3-Carboxypropionamide, N-methyl-N-[4-(1-pyrrolidinyl)-2-butynyl]-](/api/spectrum/If8vVfFb2Wa/structure.png?h=300&w=458 "3-Carboxypropionamide, N-methyl-N-[4-(1-pyrrolidinyl)-2-butynyl]-")
| SpectraBase Compound ID | KDvhGuOI1ZQ |
|---|---|
| InChI | InChI=1S/C13H20N2O3/c1-14(12(16)6-7-13(17)18)8-2-3-9-15-10-4-5-11-15/h4-11H2,1H3,(H,17,18) |
| InChIKey | JTTPGMRULUVVEK-UHFFFAOYSA-N |
| Mol Weight | 252.31 g/mol |
| Molecular Formula | C13H20N2O3 |
| Exact Mass | 252.147393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | If8vVfFb2Wa |
|---|---|
| Name | 3-Carboxypropionamide, N-methyl-N-[4-(1-pyrrolidinyl)-2-butynyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.147392509 u |
| Formula | C13H20N2O3 |
| InChI | InChI=1S/C13H20N2O3/c1-14(12(16)6-7-13(17)18)8-2-3-9-15-10-4-5-11-15/h4-11H2,1H3,(H,17,18) |
| InChIKey | JTTPGMRULUVVEK-UHFFFAOYSA-N |
| Molecular Weight | 252.314 g/mol |
| SMILES | C1N(CCC1)CC#CCN(C)C(CCC(O)=O)=O |