| SpectraBase Spectrum ID |
H2Yd0bCwVIh |
| Name |
3-Butyl-8-hydroxy-4(3H)-quinazolinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
218.105527697 u |
| Formula |
C12H14N2O2 |
| InChI |
InChI=1S/C12H14N2O2/c1-2-3-7-14-8-13-11-9(12(14)16)5-4-6-10(11)15/h4-6,8,15H,2-3,7H2,1H3 |
| InChIKey |
MUFDTPYAJBAWDS-UHFFFAOYSA-N |
| Molecular Weight |
218.256 g/mol |
| SMILES |
OC=1C=2N=CN(C(C2C=CC1)=O)CCCC |
| Spectrum/Structure Validation Score (Raman) |
0.854987 |