| SpectraBase Spectrum ID |
8Y3akiij5Lj |
| Name |
1-(4-Methoxybenzoyl)-4-oxo-2,3-dihydroquinoline-2-carbonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.100442316 u |
| Formula |
C18H14N2O3 |
| InChI |
InChI=1S/C18H14N2O3/c1-23-14-8-6-12(7-9-14)18(22)20-13(11-19)10-17(21)15-4-2-3-5-16(15)20/h2-9,13H,10H2,1H3 |
| InChIKey |
RYAXBIHQAASKCQ-UHFFFAOYSA-N |
| Molecular Weight |
306.321 g/mol |
| SMILES |
C1=2N(C(CC(C2C=CC=C1)=O)C#N)C(C1=CC=C(C=C1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842829 |
