| SpectraBase Compound ID | HQ7Myl8D16I |
|---|---|
| InChI | InChI=1S/C9H15NO3/c1-2-3-4-10-6-7(9(12)13)5-8(10)11/h7H,2-6H2,1H3,(H,12,13)/t7-/m1/s1 |
| InChIKey | LLPSQGIRADJCIU-SSDOTTSWSA-N |
| Mol Weight | 185.22 g/mol |
| Molecular Formula | C9H15NO3 |
| Exact Mass | 185.105193 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8VCXTlokuLU |
|---|---|
| Name | (3R)-1-Butyl-5-keto-pyrrolidine-3-carboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 185.105193344 u |
| Formula | C9H15NO3 |
| InChI | InChI=1S/C9H15NO3/c1-2-3-4-10-6-7(9(12)13)5-8(10)11/h7H,2-6H2,1H3,(H,12,13)/t7-/m1/s1 |
| InChIKey | LLPSQGIRADJCIU-SSDOTTSWSA-N |
| Molecular Weight | 185.223 g/mol |
| SMILES | [C@@]1(C(=O)O)(CN(CCCC)C(C1)=O)[H] |