| SpectraBase Compound ID | DlFVKjepyVB |
|---|---|
| InChI | InChI=1S/C9H14N2O/c1-7(12)5-8(6-10)11-9(2,3)4/h5,12H,1-4H3/b7-5-,11-8- |
| InChIKey | PYRYNLPVJRPFIR-HRTWQDJISA-N |
| Mol Weight | 166.22 g/mol |
| Molecular Formula | C9H14N2O |
| Exact Mass | 166.110613 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 | 7EHGpKQ8NBT |
|---|---|
| Name | 2-T-Butylimino-4-hydroxy-pent-3-enenitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.110613078 u |
| Formula | C9H14N2O |
| InChI | InChI=1S/C9H14N2O/c1-7(12)5-8(6-10)11-9(2,3)4/h5,12H,1-4H3/b7-5-,11-8- |
| InChIKey | PYRYNLPVJRPFIR-HRTWQDJISA-N |
| Molecular Weight | 166.224 g/mol |
| SMILES | CC(\N=C\(\C=C\(C)O)C#N)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.873658 |