SpectraBase Spectrum ID |
uiwCnH0q9a |
Name |
1,3,5-Triallyl-2,4-dioxohexahydro-1,3,5-triazine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.132076797 u |
Formula |
C12H17N3O2 |
InChI |
InChI=1S/C12H17N3O2/c1-4-7-13-10-14(8-5-2)12(17)15(9-6-3)11(13)16/h4-6H,1-3,7-10H2 |
InChIKey |
PCDYXJDTBADWSU-UHFFFAOYSA-N |
Molecular Weight |
235.287 g/mol |
SMILES |
C1(N(C(N(CN1CC=C)CC=C)=O)CC=C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.861695 |