CID 6410813

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

Structural Information

Molecular Formula
C23H26N4O
SMILES
C1COCCN1CCNC2=NN=C(C=C2CC3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C23H26N4O/c1-3-7-19(8-4-1)17-21-18-22(20-9-5-2-6-10-20)25-26-23(21)24-11-12-27-13-15-28-16-14-27/h1-10,18H,11-17H2,(H,24,26)
InChIKey
KPSXDGNFHFHNQT-UHFFFAOYSA-N
Compound name
4-benzyl-N-(2-morpholin-4-ylethyl)-6-phenylpyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

374.21066 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.21794 192.6
[M+Na]+ 397.19988 195.7
[M-H]- 373.20338 199.8
[M+NH4]+ 392.24448 197.2
[M+K]+ 413.17382 189.5
[M+H-H2O]+ 357.20792 178.5
[M+HCOO]- 419.20886 208.0
[M+CH3COO]- 433.22451 199.6
[M+Na-2H]- 395.18533 197.2
[M]+ 374.21011 188.2
[M]- 374.21121 188.2
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.