CID 211542

3(2h)-pyridazinone, 4,6-diphenyl-2-(2-morpholinoethyl)-

Structural Information

Molecular Formula
C22H23N3O2
SMILES
C1COCCN1CCN2C(=O)C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C22H23N3O2/c26-22-20(18-7-3-1-4-8-18)17-21(19-9-5-2-6-10-19)23-25(22)12-11-24-13-15-27-16-14-24/h1-10,17H,11-16H2
InChIKey
QBSCZYSWMPMLPB-UHFFFAOYSA-N
Compound name
2-(2-morpholin-4-ylethyl)-4,6-diphenylpyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

361.17902 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.186296 189.7
[M+Na]+ 384.168238 195.1
[M-H]- 360.171744 197.6
[M+NH4]+ 379.212843 195.3
[M+K]+ 400.142178 189.3
[M+H-H2O]+ 344.176280 175.9
[M+HCOO]- 406.177221 204.6
[M+CH3COO]- 420.192871 197.7
[M+Na-2H]- 382.153686 193.0
[M]+ 361.17847142 186.6
[M]- 361.17956858 186.6
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.