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]+ 333.207376 181.8
[M+Na]+ 355.189318 186.8
[M-H]- 331.192824 189.4
[M+NH4]+ 350.233923 192.2
[M+K]+ 371.163258 181.2
[M+H-H2O]+ 315.197360 169.7
[M+HCOO]- 377.198301 204.8
[M+CH3COO]- 391.213951 191.4
[M+Na-2H]- 353.174766 187.7
[M]+ 332.19955142 182.1
[M]- 332.20064858 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.