SpectraBase Spectrum ID |
27RL6C9d87a |
Name |
3-(4-Hydroxy-3,5-xylyl)-2-propyl-4(3H)-quinazolinone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
308.152477890 u |
Formula |
C19H20N2O2 |
InChI |
InChI=1S/C19H20N2O2/c1-4-7-17-20-16-9-6-5-8-15(16)19(23)21(17)14-10-12(2)18(22)13(3)11-14/h5-6,8-11,22H,4,7H2,1-3H3 |
InChIKey |
YXIWNSLZQISSPB-UHFFFAOYSA-N |
SMILES |
OC=1C(=CC(=CC1C)N1C(=NC=2C=CC=CC2C1=O)CCC)C |
Spectrum/Structure Validation Score (Raman) |
0.855906 |