CID 207186

Ag 259

Structural Information

Molecular Formula
C17H20ClN3O2
SMILES
CC1=CC(=NN(C1=O)CCN2CCOCC2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C17H20ClN3O2/c1-13-12-16(14-2-4-15(18)5-3-14)19-21(17(13)22)7-6-20-8-10-23-11-9-20/h2-5,12H,6-11H2,1H3
InChIKey
AIAWWTCGCURYFZ-UHFFFAOYSA-N
Compound name
6-(4-chlorophenyl)-4-methyl-2-(2-morpholin-4-ylethyl)pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

333.1244 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.13168 178.2
[M+Na]+ 356.11362 194.8
[M+NH4]+ 351.15822 185.5
[M+K]+ 372.08756 186.3
[M-H]- 332.11712 184.2
[M+Na-2H]- 354.09907 186.6
[M]+ 333.12385 182.7
[M]- 333.12495 182.7
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.