SpectraBase Spectrum ID |
AspuAFPZkGc |
Name |
1-(4,4-Dimethyl-4H-benzo[H]quinolin-1-yl)-ethanone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
251.131014170 u |
Formula |
C17H17NO |
InChI |
InChI=1S/C17H17NO/c1-12(19)18-11-10-17(2,3)15-9-8-13-6-4-5-7-14(13)16(15)18/h4-11H,1-3H3 |
InChIKey |
HHMKSTBSRBYXCF-UHFFFAOYSA-N |
Molecular Weight |
251.329 g/mol |
SMILES |
C=1C=C2C(=CC1)C=CC1=C2N(C=CC1(C)C)C(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955174 |