| SpectraBase Spectrum ID |
1MlWDW2hQSn |
| Name |
(Z)-1-Hexyl-3-((hexylimino)(2-hydroxyphenyl)methyl)quinolin-4(1H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.277678405 u |
| Formula |
C28H36N2O2 |
| InChI |
InChI=1S/C28H36N2O2/c1-3-5-7-13-19-29-27(23-16-10-12-18-26(23)31)24-21-30(20-14-8-6-4-2)25-17-11-9-15-22(25)28(24)32/h9-12,15-18,21,31H,3-8,13-14,19-20H2,1-2H3/b29-27- |
| InChIKey |
QLKDODFSKUYWBF-OHYPFYFLSA-N |
| Molecular Weight |
432.608 g/mol |
| SMILES |
C=1C=CC(=C(C1)O)\C(C1=CN(CCCCCC)C=2C=CC=CC2C1=O)=N\CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973588 |
