CID 471280

Chembl19815

Structural Information

Molecular Formula
C21H24N4O
SMILES
CN1C2=CC=CC=C2C3=C4C(=C(C=C31)OC)C=CN=C4NCCN(C)C
InChI
InChI=1S/C21H24N4O/c1-24(2)12-11-23-21-20-15(9-10-22-21)18(26-4)13-17-19(20)14-7-5-6-8-16(14)25(17)3/h5-10,13H,11-12H2,1-4H3,(H,22,23)
InChIKey
HXXBCACHFFWOLB-UHFFFAOYSA-N
Compound name
N-(5-methoxy-7-methylpyrido[4,3-c]carbazol-1-yl)-N',N'-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

348.195 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.20228 184.9
[M+Na]+ 371.18422 195.5
[M-H]- 347.18772 191.0
[M+NH4]+ 366.22882 201.0
[M+K]+ 387.15816 190.0
[M+H-H2O]+ 331.19226 175.2
[M+HCOO]- 393.19320 208.1
[M+CH3COO]- 407.20885 196.4
[M+Na-2H]- 369.16967 191.6
[M]+ 348.19445 192.8
[M]- 348.19555 192.8
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.