| SpectraBase Spectrum ID |
CIDQ3yaHUhk |
| Name |
[2-(5-Hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)-1-methyleneethyl]benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.079706870 u |
| Formula |
C13H12N2O4 |
| InChI |
InChI=1S/C13H12N2O4/c1-8(9-5-3-2-4-6-9)7-13(19)10(16)14-12(18)15-11(13)17/h2-6,19H,1,7H2,(H2,14,15,16,17,18) |
| InChIKey |
ICHBQTHCSGEYHR-UHFFFAOYSA-N |
| Molecular Weight |
260.249 g/mol |
| SMILES |
C1(C(NC(NC1=O)=O)=O)(CC(C1=CC=CC=C1)=C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977676 |
![[2-(5-Hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)-1-methyleneethyl]benzene](/api/spectrum/CIDQ3yaHUhk/structure.png?h=300&w=458 "[2-(5-Hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)-1-methyleneethyl]benzene")
