| SpectraBase Compound ID | CjYuRxL26G7 |
|---|---|
| InChI | InChI=1S/C9H17NO/c1-4-7-9(11)8(5-2)10-6-3/h4-7H2,1-3H3/b10-8- |
| InChIKey | GZDRSQMLJKJLRF-NTMALXAHSA-N |
| Mol Weight | 155.24 g/mol |
| Molecular Formula | C9H17NO |
| Exact Mass | 155.131014 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HSmyNgBMmlG |
|---|---|
| Name | 3-(N-Ethyl)imino-4-heptanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 155.131014170 u |
| Formula | C9H17NO |
| InChI | InChI=1S/C9H17NO/c1-4-7-9(11)8(5-2)10-6-3/h4-7H2,1-3H3/b10-8- |
| InChIKey | GZDRSQMLJKJLRF-NTMALXAHSA-N |
| Molecular Weight | 155.241 g/mol |
| SMILES | C(\C(=N/CC)CC)(=O)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94222 |