CID 146560

115464-65-8

Structural Information

Molecular Formula
C21H23N3O
SMILES
CCCNC1=NC=CC2=C(C3=C(C(=C21)C)C4=C(N3)C=CC(=C4)OC)C
InChI
InChI=1S/C21H23N3O/c1-5-9-22-21-19-13(3)18-16-11-14(25-4)6-7-17(16)24-20(18)12(2)15(19)8-10-23-21/h6-8,10-11,24H,5,9H2,1-4H3,(H,22,23)
InChIKey
IVJJDPXPMNELBZ-UHFFFAOYSA-N
Compound name
9-methoxy-5,11-dimethyl-N-propyl-6H-pyrido[4,3-b]carbazol-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

333.1841 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.191376 182.3
[M+Na]+ 356.173318 194.4
[M-H]- 332.176824 186.2
[M+NH4]+ 351.217923 198.5
[M+K]+ 372.147258 186.6
[M+H-H2O]+ 316.181360 173.7
[M+HCOO]- 378.182301 202.5
[M+CH3COO]- 392.197951 193.6
[M+Na-2H]- 354.158766 187.8
[M]+ 333.18355142 188.4
[M]- 333.18464858 188.4
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.