CID 69041

9-phenylacridine

Structural Information

Molecular Formula
C19H13N
SMILES
C1=CC=C(C=C1)C2=C3C=CC=CC3=NC4=CC=CC=C42
InChI
InChI=1S/C19H13N/c1-2-8-14(9-3-1)19-15-10-4-6-12-17(15)20-18-13-7-5-11-16(18)19/h1-13H
InChIKey
MTRFEWTWIPAXLG-UHFFFAOYSA-N
Compound name
9-phenylacridine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

13656
Patents

255.1048 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.112076 157.3
[M+Na]+ 278.094018 167.3
[M-H]- 254.097524 164.6
[M+NH4]+ 273.138623 174.5
[M+K]+ 294.067958 160.2
[M+H-H2O]+ 238.102060 147.8
[M+HCOO]- 300.103001 179.3
[M+CH3COO]- 314.118651 169.9
[M+Na-2H]- 276.079466 168.2
[M]+ 255.10425142 157.8
[M]- 255.10534858 157.8
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

patents stripe