CID 6410855

N'-(6-(4-chlorophenyl)-4-phenyl-3-pyridazinyl)-n,n-dimethyl-1,3-propanediamine

Structural Information

Molecular Formula
C21H23ClN4
SMILES
CN(C)CCCNC1=NN=C(C=C1C2=CC=CC=C2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C21H23ClN4/c1-26(2)14-6-13-23-21-19(16-7-4-3-5-8-16)15-20(24-25-21)17-9-11-18(22)12-10-17/h3-5,7-12,15H,6,13-14H2,1-2H3,(H,23,25)
InChIKey
OFLQCPASFULKPO-UHFFFAOYSA-N
Compound name
N-[6-(4-chlorophenyl)-4-phenylpyridazin-3-yl]-N',N'-dimethylpropane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.16113 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.16841 190.7
[M+Na]+ 389.15035 207.3
[M+NH4]+ 384.19495 199.1
[M+K]+ 405.12429 196.7
[M-H]- 365.15385 198.6
[M+Na-2H]- 387.13580 202.5
[M]+ 366.16058 195.8
[M]- 366.16168 195.8
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.