| SpectraBase Compound ID | KPgz3gPCuCl |
|---|---|
| InChI | InChI=1S/C9H17NO3/c11-7-8-2-1-4-10(6-8)5-3-9(12)13/h8,11H,1-7H2,(H,12,13) |
| InChIKey | APRMLBQVNDDKNP-UHFFFAOYSA-N |
| Mol Weight | 187.24 g/mol |
| Molecular Formula | C9H17NO3 |
| Exact Mass | 187.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7XAdJAN82wP |
|---|---|
| Name | 1-Pyridinepropanoic acid, hexahydro-3-(hydroxymethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.120843408 u |
| Formula | C9H17NO3 |
| InChI | InChI=1S/C9H17NO3/c11-7-8-2-1-4-10(6-8)5-3-9(12)13/h8,11H,1-7H2,(H,12,13) |
| InChIKey | APRMLBQVNDDKNP-UHFFFAOYSA-N |
| Molecular Weight | 187.239 g/mol |
| SMILES | C1C(CO)CN(CC1)CCC(=O)O |