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]+ 334.19138 182.3
[M+Na]+ 356.17332 194.4
[M-H]- 332.17682 186.2
[M+NH4]+ 351.21792 198.5
[M+K]+ 372.14726 186.6
[M+H-H2O]+ 316.18136 173.7
[M+HCOO]- 378.18230 202.5
[M+CH3COO]- 392.19795 193.6
[M+Na-2H]- 354.15877 187.8
[M]+ 333.18355 188.4
[M]- 333.18465 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.