CID 211588

23419-44-5

Structural Information

Molecular Formula
C24H28ClN3O
SMILES
CC(C)N(CCN1C(=O)C(=CC(=N1)C2=CC(=CC=C2)Cl)C3=CC=CC=C3)C(C)C
InChI
InChI=1S/C24H28ClN3O/c1-17(2)27(18(3)4)13-14-28-24(29)22(19-9-6-5-7-10-19)16-23(26-28)20-11-8-12-21(25)15-20/h5-12,15-18H,13-14H2,1-4H3
InChIKey
SVNVEGCTKZMGMQ-UHFFFAOYSA-N
Compound name
6-(3-chlorophenyl)-2-[2-[di(propan-2-yl)amino]ethyl]-4-phenylpyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

409.19208 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.19936 200.4
[M+Na]+ 432.18130 207.0
[M-H]- 408.18480 208.2
[M+NH4]+ 427.22590 209.1
[M+K]+ 448.15524 200.5
[M+H-H2O]+ 392.18934 188.9
[M+HCOO]- 454.19028 215.0
[M+CH3COO]- 468.20593 232.2
[M+Na-2H]- 430.16675 199.8
[M]+ 409.19153 205.1
[M]- 409.19263 205.1
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.