CID 6410857

3-pyridazinamine, n-(3-(dimethylamino)propyl)-4,6-diphenyl-

Structural Information

Molecular Formula
C21H24N4
SMILES
CN(C)CCCNC1=NN=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C21H24N4/c1-25(2)15-9-14-22-21-19(17-10-5-3-6-11-17)16-20(23-24-21)18-12-7-4-8-13-18/h3-8,10-13,16H,9,14-15H2,1-2H3,(H,22,24)
InChIKey
KUWXYYYWTUKUNX-UHFFFAOYSA-N
Compound name
N-(4,6-diphenylpyridazin-3-yl)-N',N'-dimethylpropane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.2001 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.20738 181.8
[M+Na]+ 355.18932 186.8
[M-H]- 331.19282 189.4
[M+NH4]+ 350.23392 192.2
[M+K]+ 371.16326 181.2
[M+H-H2O]+ 315.19736 169.7
[M+HCOO]- 377.19830 204.8
[M+CH3COO]- 391.21395 191.4
[M+Na-2H]- 353.17477 187.7
[M]+ 332.19955 182.1
[M]- 332.20065 182.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.