| SpectraBase Spectrum ID |
B6lsu8w00Kx |
| Name |
2H-Quinoline-1-carboxamide, 2,2,4-trimethyl-4-phenyl-3,4-dihydro-N-(4-fluorophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.195091595 u |
| Formula |
C25H25FN2O |
| InChI |
InChI=1S/C25H25FN2O/c1-24(2)17-25(3,18-9-5-4-6-10-18)21-11-7-8-12-22(21)28(24)23(29)27-20-15-13-19(26)14-16-20/h4-16H,17H2,1-3H3,(H,27,29) |
| InChIKey |
PLTHCBBZEADQJT-UHFFFAOYSA-N |
| Molecular Weight |
388.486 g/mol |
| SMILES |
C1=CC=C(C=C1)C1(CC(N(C(NC2=CC=C(C=C2)F)=O)C2=C1C=CC=C2)(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873772 |
