CID 153725

6h-pyrido(4,3-b)carbazole, 1-((2-aminoethyl)amino)-9-methoxy-5-methyl-, hemihydrate

Structural Information

Molecular Formula
C19H20N4O
SMILES
CC1=C2C=CN=C(C2=CC3=C1NC4=C3C=C(C=C4)OC)NCCN
InChI
InChI=1S/C19H20N4O/c1-11-13-5-7-21-19(22-8-6-20)16(13)10-15-14-9-12(24-2)3-4-17(14)23-18(11)15/h3-5,7,9-10,23H,6,8,20H2,1-2H3,(H,21,22)
InChIKey
DDCKUULCSVIYPY-UHFFFAOYSA-N
Compound name
N'-(9-methoxy-5-methyl-6H-pyrido[4,3-b]carbazol-1-yl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

320.1637 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.17098 175.9
[M+Na]+ 343.15292 191.1
[M+NH4]+ 338.19752 184.4
[M+K]+ 359.12686 184.2
[M-H]- 319.15642 180.0
[M+Na-2H]- 341.13837 181.8
[M]+ 320.16315 179.3
[M]- 320.16425 179.3
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.