| SpectraBase Spectrum ID |
AXoTiZxfWTX |
| Name |
2-(1-Hydroxy-1-phenylethyl)-1-methyl-4-quinolone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
279.125928789 u |
| Formula |
C18H17NO2 |
| InChI |
InChI=1S/C18H17NO2/c1-18(21,13-8-4-3-5-9-13)17-12-16(20)14-10-6-7-11-15(14)19(17)2/h3-12,21H,1-2H3 |
| InChIKey |
GVSGSKINYIAOPW-UHFFFAOYSA-N |
| Molecular Weight |
279.339 g/mol |
| SMILES |
C=1(N(C=2C=CC=CC2C(C1)=O)C)C(C1=CC=CC=C1)(O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840548 |