| SpectraBase Spectrum ID |
1aP8Zoc2ZPY |
| Name |
1,3,7,10-Tetramethylcyclooctapyrimidine-2,4-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.121177761 u |
| Formula |
C14H16N2O2 |
| InChI |
InChI=1S/C14H16N2O2/c1-9-5-7-10(2)12-11(8-6-9)13(17)16(4)14(18)15(12)3/h5-8H,1-4H3/b7-5-,8-6-,9-5-,9-6-,10-7-,11-8+,12-10+ |
| InChIKey |
QJZIWFKOUBMANO-FEAVIFBNSA-N |
| Molecular Weight |
244.294 g/mol |
| SMILES |
C1=2C(N(C)C(N(C2\C(=C/C=C\(\C=C/1)C)C)C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96862 |
