SpectraBase Spectrum ID |
4cLP4ir9GyP |
Name |
4-(3,4-Dihydro-1(2H)-quinolinylcarbonyl)aniline, ac derivative |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
294.136827826 u |
Formula |
C18H18N2O2 |
InChI |
InChI=1S/C18H18N2O2/c1-13(21)19-16-10-8-15(9-11-16)18(22)20-12-4-6-14-5-2-3-7-17(14)20/h2-3,5,7-11H,4,6,12H2,1H3,(H,19,21) |
InChIKey |
BTHHYGOCYRAYLZ-UHFFFAOYSA-N |
Molecular Weight |
294.354 g/mol |
SMILES |
C1(NC(=O)C)=CC=C(C=C1)C(=O)N1CCCC2=C1C=CC=C2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942991 |