![alpha-Amino-1H-pyrrolo[2,3-B]pyridine-3-propionic acid](/api/spectrum/13ROJ1fAa31/structure.png?h=300&w=458 "alpha-Amino-1H-pyrrolo[2,3-B]pyridine-3-propionic acid")
| SpectraBase Compound ID | 4rdD1UYU29U |
|---|---|
| InChI | InChI=1S/C10H11N3O2/c11-8(10(14)15)4-6-5-13-9-7(6)2-1-3-12-9/h1-3,5,8H,4,11H2,(H,12,13)(H,14,15) |
| InChIKey | SNLOIIPRZGMRAB-UHFFFAOYSA-N |
| Mol Weight | 205.22 g/mol |
| Molecular Formula | C10H11N3O2 |
| Exact Mass | 205.085127 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 13ROJ1fAa31 |
|---|---|
| Name | alpha-Amino-1H-pyrrolo[2,3-B]pyridine-3-propionic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.085126604 u |
| Formula | C10H11N3O2 |
| InChI | InChI=1S/C10H11N3O2/c11-8(10(14)15)4-6-5-13-9-7(6)2-1-3-12-9/h1-3,5,8H,4,11H2,(H,12,13)(H,14,15) |
| InChIKey | SNLOIIPRZGMRAB-UHFFFAOYSA-N |
| SMILES | N1C=2N=CC=CC2C(CC(C(O)=O)N)=C1 |