SpectraBase Spectrum ID |
EoLc7SFTbT9 |
Name |
5-Benzoyloxy-1,3-dimethyluracil |
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/c1-14-8-10(11(16)15(2)13(14)18)19-12(17)9-6-4-3-5-7-9/h3-8H,1-2H3 |
InChIKey |
CQRDCGCHIBGYMQ-UHFFFAOYSA-N |
Molecular Weight |
260.249 g/mol |
SMILES |
C1(N(C(C(=CN1C)OC(=O)C1=CC=CC=C1)=O)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969398 |