CID 211559

4-(m-fluorophenyl)-2-(2-morpholinoethyl)-6-phenyl-3(2h)-pyridazinone

Structural Information

Molecular Formula
C22H22FN3O2
SMILES
C1COCCN1CCN2C(=O)C(=C(C=N2)C3=CC=CC=C3)C4=CC(=CC=C4)F
InChI
InChI=1S/C22H22FN3O2/c23-19-8-4-7-18(15-19)21-20(17-5-2-1-3-6-17)16-24-26(22(21)27)10-9-25-11-13-28-14-12-25/h1-8,15-16H,9-14H2
InChIKey
VWAAUHLNJPQXOB-UHFFFAOYSA-N
Compound name
4-(3-fluorophenyl)-2-(2-morpholin-4-ylethyl)-5-phenylpyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

379.16962 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.17690 194.9
[M+Na]+ 402.15884 211.2
[M+NH4]+ 397.20344 201.3
[M+K]+ 418.13278 202.1
[M-H]- 378.16234 201.8
[M+Na-2H]- 400.14429 204.7
[M]+ 379.16907 199.3
[M]- 379.17017 199.3
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.