CID 372654

Nsc648151

Structural Information

Molecular Formula
C22H15NO2
SMILES
CC1=CC2=C(C3=C1C(=O)C4=CC=CC=C4C3=O)N(C5=CC=CC=C52)C
InChI
InChI=1S/C22H15NO2/c1-12-11-16-13-7-5-6-10-17(13)23(2)20(16)19-18(12)21(24)14-8-3-4-9-15(14)22(19)25/h3-11H,1-2H3
InChIKey
JIQCZCPEXMBTSV-UHFFFAOYSA-N
Compound name
6,12-dimethylnaphtho[3,2-a]carbazole-5,13-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.1103 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.11758 176.8
[M+Na]+ 348.09952 190.0
[M-H]- 324.10302 184.1
[M+NH4]+ 343.14412 196.0
[M+K]+ 364.07346 182.3
[M+H-H2O]+ 308.10756 168.4
[M+HCOO]- 370.10850 195.5
[M+CH3COO]- 384.12415 189.2
[M+Na-2H]- 346.08497 181.5
[M]+ 325.10975 181.0
[M]- 325.11085 181.0
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.