CID 6410842

118269-96-8

Structural Information

Molecular Formula
C17H23N5O
SMILES
CC1=CC(=NN=C1NCCN2CCOCC2)C3=CC=C(C=C3)N
InChI
InChI=1S/C17H23N5O/c1-13-12-16(14-2-4-15(18)5-3-14)20-21-17(13)19-6-7-22-8-10-23-11-9-22/h2-5,12H,6-11,18H2,1H3,(H,19,21)
InChIKey
IKHUWWDFEZONFW-UHFFFAOYSA-N
Compound name
6-(4-aminophenyl)-4-methyl-N-(2-morpholin-4-ylethyl)pyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

313.19025 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.19753 177.9
[M+Na]+ 336.17947 182.7
[M-H]- 312.18297 182.9
[M+NH4]+ 331.22407 185.6
[M+K]+ 352.15341 178.1
[M+H-H2O]+ 296.18751 165.9
[M+HCOO]- 358.18845 194.8
[M+CH3COO]- 372.20410 186.3
[M+Na-2H]- 334.16492 182.2
[M]+ 313.18970 173.5
[M]- 313.19080 173.5
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.