CID 6410852

3-pyridazinamine, n-(2-(dimethylamino)ethyl)-6-(4-fluorophenyl)-4-phenyl-

Structural Information

Molecular Formula
C20H21FN4
SMILES
CN(C)CCNC1=NN=C(C=C1C2=CC=CC=C2)C3=CC=C(C=C3)F
InChI
InChI=1S/C20H21FN4/c1-25(2)13-12-22-20-18(15-6-4-3-5-7-15)14-19(23-24-20)16-8-10-17(21)11-9-16/h3-11,14H,12-13H2,1-2H3,(H,22,24)
InChIKey
SKFCBFMCFBCFHW-UHFFFAOYSA-N
Compound name
N-[6-(4-fluorophenyl)-4-phenylpyridazin-3-yl]-N',N'-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.17502 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.18230 181.3
[M+Na]+ 359.16424 187.8
[M-H]- 335.16774 188.1
[M+NH4]+ 354.20884 191.8
[M+K]+ 375.13818 181.8
[M+H-H2O]+ 319.17228 168.6
[M+HCOO]- 381.17322 203.5
[M+CH3COO]- 395.18887 191.0
[M+Na-2H]- 357.14969 186.2
[M]+ 336.17447 180.7
[M]- 336.17557 180.7
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.