| SpectraBase Compound ID | BMd8Hg8dkNu |
|---|---|
| InChI | InChI=1S/C7H9NO/c1-2-8-5-3-4-7(8)6-9/h3-6H,2H2,1H3 |
| InChIKey | DVLGEHCERRWDIX-UHFFFAOYSA-N |
| Mol Weight | 123.15 g/mol |
| Molecular Formula | C7H9NO |
| Exact Mass | 123.068414 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7PqqiNx7nff |
|---|---|
| Name | 1H-Pyrrole-2-carboxaldehyde, 1-ethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 123.068413913 u |
| Formula | C7H9NO |
| InChI | InChI=1S/C7H9NO/c1-2-8-5-3-4-7(8)6-9/h3-6H,2H2,1H3 |
| InChIKey | DVLGEHCERRWDIX-UHFFFAOYSA-N |
| Molecular Weight | 123.155 g/mol |
| SMILES | C(=O)C=1N(CC)C=CC1 |