SpectraBase Spectrum ID |
5huNLHFEVzU |
Name |
5-(2-Hydroxy-5-methoxy-benzylidene)-pyrimidine-2,4,6-trione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
262.058971425 u |
Formula |
C12H10N2O5 |
InChI |
InChI=1S/C12H10N2O5/c1-19-7-2-3-9(15)6(4-7)5-8-10(16)13-12(18)14-11(8)17/h2-5,15H,1H3,(H2,13,14,16,17,18) |
InChIKey |
NBHZUUXGMHPVRR-UHFFFAOYSA-N |
SMILES |
C1(NC(C(C(N1)=O)=CC1=C(C=CC(=C1)OC)O)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932035 |