CID 149800

N-benzylacridin-9-amine

Structural Information

Molecular Formula
C20H16N2
SMILES
C1=CC=C(C=C1)CNC2=C3C=CC=CC3=NC4=CC=CC=C42
InChI
InChI=1S/C20H16N2/c1-2-8-15(9-3-1)14-21-20-16-10-4-6-12-18(16)22-19-13-7-5-11-17(19)20/h1-13H,14H2,(H,21,22)
InChIKey
BCTFNTVNBAELQN-UHFFFAOYSA-N
Compound name
N-benzylacridin-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

5
Patents

284.13135 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.13863 164.3
[M+Na]+ 307.12057 173.1
[M-H]- 283.12407 171.3
[M+NH4]+ 302.16517 180.0
[M+K]+ 323.09451 165.7
[M+H-H2O]+ 267.12861 154.5
[M+HCOO]- 329.12955 187.1
[M+CH3COO]- 343.14520 176.0
[M+Na-2H]- 305.10602 175.5
[M]+ 284.13080 164.6
[M]- 284.13190 164.6
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.