| SpectraBase Spectrum ID |
HUPZuxsNAG4 |
| Name |
6-Amino-4-hydroxy-1-(4-methoxybenzyl)-2(1H)-pyrimidinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.095691288 u |
| Formula |
C12H13N3O3 |
| InChI |
InChI=1S/C12H13N3O3/c1-18-9-4-2-8(3-5-9)7-15-10(13)6-11(16)14-12(15)17/h2-6H,7,13H2,1H3,(H,14,16,17) |
| InChIKey |
UDFDHBNPYGFDSI-UHFFFAOYSA-N |
| Molecular Weight |
247.254 g/mol |
| SMILES |
C=1(N(C(NC(C1)=O)=O)CC1=CC=C(C=C1)OC)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879476 |
