| SpectraBase Spectrum ID |
2Sa6OI0bPRn |
| Name |
5-[(3,4-Dimethoxyphenyl)carbonyl]-1,3,6-trimethylpyrimidine-2,4-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.121571683 u |
| Formula |
C16H18N2O5 |
| InChI |
InChI=1S/C16H18N2O5/c1-9-13(15(20)18(3)16(21)17(9)2)14(19)10-6-7-11(22-4)12(8-10)23-5/h6-8H,1-5H3 |
| InChIKey |
LQQBWJFXZYQBQM-UHFFFAOYSA-N |
| Molecular Weight |
318.329 g/mol |
| SMILES |
COC1=C(OC)C=CC(C(C=2C(N(C(=O)N(C)C2C)C)=O)=O)=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950978 |
![5-[(3,4-Dimethoxyphenyl)carbonyl]-1,3,6-trimethylpyrimidine-2,4-dione](/api/spectrum/2Sa6OI0bPRn/structure.png?h=300&w=458 "5-[(3,4-Dimethoxyphenyl)carbonyl]-1,3,6-trimethylpyrimidine-2,4-dione")
