| SpectraBase Spectrum ID |
AiuCdVUci1a |
| Name |
2(1H)-Pyrazinone, 1-cyclohexyl-5-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
254.141913207 u |
| Formula |
C16H18N2O |
| InChI |
InChI=1S/C16H18N2O/c19-16-11-17-15(13-7-3-1-4-8-13)12-18(16)14-9-5-2-6-10-14/h1,3-4,7-8,11-12,14H,2,5-6,9-10H2 |
| InChIKey |
FSHNJNGTJOCHJH-UHFFFAOYSA-N |
| Molecular Weight |
254.333 g/mol |
| SMILES |
C=1N(C(C=NC1C1=CC=CC=C1)=O)C1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.82961 |
