CID 6410831

4-morpholineethanamine, n-(4-methyl-6-(4-methylphenyl)-3-pyridazinyl)-, dihydrochloride

Structural Information

Molecular Formula
C18H24N4O
SMILES
CC1=CC=C(C=C1)C2=NN=C(C(=C2)C)NCCN3CCOCC3
InChI
InChI=1S/C18H24N4O/c1-14-3-5-16(6-4-14)17-13-15(2)18(21-20-17)19-7-8-22-9-11-23-12-10-22/h3-6,13H,7-12H2,1-2H3,(H,19,21)
InChIKey
LVXHNBYZWWJQOK-UHFFFAOYSA-N
Compound name
4-methyl-6-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

312.195 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.202276 178.8
[M+Na]+ 335.184218 183.9
[M-H]- 311.187724 184.0
[M+NH4]+ 330.228823 187.1
[M+K]+ 351.158158 179.5
[M+H-H2O]+ 295.192260 166.7
[M+HCOO]- 357.193201 194.9
[M+CH3COO]- 371.208851 187.5
[M+Na-2H]- 333.169666 182.8
[M]+ 312.19445142 176.1
[M]- 312.19554858 176.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.