CID 3049068

Brn 0452298

Structural Information

Molecular Formula
C23H26ClN3O
SMILES
CCN(CC)CCNC1=CC(=CC(=O)N1C2=CC=C(C=C2)Cl)C3=CC=CC=C3
InChI
InChI=1S/C23H26ClN3O/c1-3-26(4-2)15-14-25-22-16-19(18-8-6-5-7-9-18)17-23(28)27(22)21-12-10-20(24)11-13-21/h5-13,16-17,25H,3-4,14-15H2,1-2H3
InChIKey
COLACPYMBNROLP-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-6-[2-(diethylamino)ethylamino]-4-phenylpyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

395.17645 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.18373 197.8
[M+Na]+ 418.16567 204.6
[M-H]- 394.16917 206.9
[M+NH4]+ 413.21027 208.3
[M+K]+ 434.13961 197.5
[M+H-H2O]+ 378.17371 186.8
[M+HCOO]- 440.17465 217.1
[M+CH3COO]- 454.19030 230.0
[M+Na-2H]- 416.15112 200.0
[M]+ 395.17590 202.2
[M]- 395.17700 202.2
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.