| SpectraBase Compound ID | ECFCM2Mkr65 |
|---|---|
| InChI | InChI=1S/C9H13NO/c1-2-3-6-9(11)7-4-5-8-10/h2-3H,4-7H2,1H3/b3-2+ |
| InChIKey | DOGBSBIWTVJLRI-NSCUHMNNSA-N |
| Mol Weight | 151.21 g/mol |
| Molecular Formula | C9H13NO |
| Exact Mass | 151.099714 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DwUp7OAMhrZ |
|---|---|
| Name | (E)-5-Ketonon-7-enenitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 151.099714042 u |
| Formula | C9H13NO |
| InChI | InChI=1S/C9H13NO/c1-2-3-6-9(11)7-4-5-8-10/h2-3H,4-7H2,1H3/b3-2+ |
| InChIKey | DOGBSBIWTVJLRI-NSCUHMNNSA-N |
| Molecular Weight | 151.209 g/mol |
| SMILES | C(#N)CCCC(=O)C\C=C\C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.832897 |