SpectraBase Spectrum ID |
KoPFaUJXBM2 |
Name |
2,4-Dicyclohexyl-6-methyl-3(2H)-pyridazinone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
274.204513464 u |
Formula |
C17H26N2O |
InChI |
InChI=1S/C17H26N2O/c1-13-12-16(14-8-4-2-5-9-14)17(20)19(18-13)15-10-6-3-7-11-15/h12,14-15H,2-11H2,1H3 |
InChIKey |
CMBRKYKYFMQYAN-UHFFFAOYSA-N |
Molecular Weight |
274.408 g/mol |
SMILES |
C1(N2N=C(C=C(C2=O)C2CCCCC2)C)CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918047 |