CID 218051

4-morpholineethanamine, n-(4-ethyl-6-phenyl-3-pyridazinyl)-, dihydrochloride, dihydrate

Structural Information

Molecular Formula
C18H24N4O
SMILES
CCC1=CC(=NN=C1NCCN2CCOCC2)C3=CC=CC=C3
InChI
InChI=1S/C18H24N4O/c1-2-15-14-17(16-6-4-3-5-7-16)20-21-18(15)19-8-9-22-10-12-23-13-11-22/h3-7,14H,2,8-13H2,1H3,(H,19,21)
InChIKey
OJRBCZYVLIYUNO-UHFFFAOYSA-N
Compound name
4-ethyl-N-(2-morpholin-4-ylethyl)-6-phenylpyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

312.195 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.202276 177.5
[M+Na]+ 335.184218 181.7
[M-H]- 311.187724 182.3
[M+NH4]+ 330.228823 185.5
[M+K]+ 351.158158 177.2
[M+H-H2O]+ 295.192260 165.2
[M+HCOO]- 357.193201 193.6
[M+CH3COO]- 371.208851 185.9
[M+Na-2H]- 333.169666 182.4
[M]+ 312.19445142 174.4
[M]- 312.19554858 174.4
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.