CID 471281

Chembl20363

Structural Information

Molecular Formula
C19H20N4O
SMILES
CN1C2=CC=CC=C2C3=C4C(=C(C=C31)OC)C=CN=C4NCCN
InChI
InChI=1S/C19H20N4O/c1-23-14-6-4-3-5-12(14)17-15(23)11-16(24-2)13-7-9-21-19(18(13)17)22-10-8-20/h3-7,9,11H,8,10,20H2,1-2H3,(H,21,22)
InChIKey
VDWIXXJTZUHFOR-UHFFFAOYSA-N
Compound name
N'-(5-methoxy-7-methylpyrido[4,3-c]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

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.17098 174.7
[M+Na]+ 343.15292 186.4
[M-H]- 319.15642 179.5
[M+NH4]+ 338.19752 191.3
[M+K]+ 359.12686 179.7
[M+H-H2O]+ 303.16096 165.9
[M+HCOO]- 365.16190 197.7
[M+CH3COO]- 379.17755 186.6
[M+Na-2H]- 341.13837 182.5
[M]+ 320.16315 180.1
[M]- 320.16425 180.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.