| SpectraBase Compound ID | 9xaTzNEpR3z |
|---|---|
| InChI | InChI=1S/C10H11NO/c12-10(8-4-5-8)7-9-3-1-2-6-11-9/h1-3,6,8H,4-5,7H2 |
| InChIKey | MBPIDEXJDRYAKY-UHFFFAOYSA-N |
| Mol Weight | 161.2 g/mol |
| Molecular Formula | C10H11NO |
| Exact Mass | 161.084064 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HvOYrkTiWCx |
|---|---|
| Name | Ethanone, 1-cyclopropyl-2-(2-pyridinyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 161.084063977 u |
| Formula | C10H11NO |
| InChI | InChI=1S/C10H11NO/c12-10(8-4-5-8)7-9-3-1-2-6-11-9/h1-3,6,8H,4-5,7H2 |
| InChIKey | MBPIDEXJDRYAKY-UHFFFAOYSA-N |
| Molecular Weight | 161.204 g/mol |
| SMILES | C(CC1=CC=CC=N1)(=O)C1CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.890698 |