CID 11515641

938155-11-4

Structural Information

Molecular Formula
C23H20N2O
SMILES
CN(C)C1=CC=C(C=C1)C(=O)CC2=NC3=CC=CC=C3C4=CC=CC=C42
InChI
InChI=1S/C23H20N2O/c1-25(2)17-13-11-16(12-14-17)23(26)15-22-20-9-4-3-7-18(20)19-8-5-6-10-21(19)24-22/h3-14H,15H2,1-2H3
InChIKey
YXUDOLSUGNSQGS-UHFFFAOYSA-N
Compound name
1-[4-(dimethylamino)phenyl]-2-phenanthridin-6-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

340.15756 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.16484 182.5
[M+Na]+ 363.14678 190.4
[M-H]- 339.15028 190.7
[M+NH4]+ 358.19138 196.3
[M+K]+ 379.12072 184.5
[M+H-H2O]+ 323.15482 171.7
[M+HCOO]- 385.15576 203.7
[M+CH3COO]- 399.17141 193.2
[M+Na-2H]- 361.13223 189.1
[M]+ 340.15701 185.3
[M]- 340.15811 185.3
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