| SpectraBase Compound ID | JV1AXlWHVlb |
|---|---|
| InChI | InChI=1S/C6H9NO/c1-7-4-2-6(8)3-5-7/h2,4H,3,5H2,1H3 |
| InChIKey | FYVXQMLPGIHTKN-UHFFFAOYSA-N |
| Mol Weight | 111.14 g/mol |
| Molecular Formula | C6H9NO |
| Exact Mass | 111.068414 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Fof1uTSlZ1n |
|---|---|
| Name | 1-Methyl-2,3-dihydropyridin-4-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 111.068413913 u |
| Formula | C6H9NO |
| InChI | InChI=1S/C6H9NO/c1-7-4-2-6(8)3-5-7/h2,4H,3,5H2,1H3 |
| InChIKey | FYVXQMLPGIHTKN-UHFFFAOYSA-N |
| Molecular Weight | 111.144 g/mol |
| SMILES | C1(=O)CCN(C=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.901561 |