CID 374505

Nsc652256

Structural Information

Molecular Formula
C22H15NO2
SMILES
CCN1C2=CC=CC=C2C3=C1C4=C(C=C3)C(=O)C5=CC=CC=C5C4=O
InChI
InChI=1S/C22H15NO2/c1-2-23-18-10-6-5-7-13(18)14-11-12-17-19(20(14)23)22(25)16-9-4-3-8-15(16)21(17)24/h3-12H,2H2,1H3
InChIKey
RFSMYRUHCLFIOJ-UHFFFAOYSA-N
Compound name
12-ethylnaphtho[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 176.3
[M+Na]+ 348.09952 188.6
[M-H]- 324.10302 183.3
[M+NH4]+ 343.14412 195.2
[M+K]+ 364.07346 180.9
[M+H-H2O]+ 308.10756 167.6
[M+HCOO]- 370.10850 195.1
[M+CH3COO]- 384.12415 188.4
[M+Na-2H]- 346.08497 181.7
[M]+ 325.10975 180.1
[M]- 325.11085 180.1
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.