SpectraBase Spectrum ID |
HOT1Au1eTy5 |
Name |
3-(2,6-Dihydroxyphenyl)-2-ethyl-4(3H)-quinazolinone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
282.100442316 u |
Formula |
C16H14N2O3 |
InChI |
InChI=1S/C16H14N2O3/c1-2-14-17-11-7-4-3-6-10(11)16(21)18(14)15-12(19)8-5-9-13(15)20/h3-9,19-20H,2H2,1H3 |
InChIKey |
DDIQTOFNXQPNMJ-UHFFFAOYSA-N |
Molecular Weight |
282.299 g/mol |
SMILES |
C12=C(C=CC=C2)N=C(N(C1=O)C1=C(C=CC=C1O)O)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.904907 |