CID 373648

Nsc650368

Structural Information

Molecular Formula
C28H20N2O2
SMILES
CCN1C2=CC=CC=C2C3=C1C4=C(C=C3C5=CC=CC=C5)C(=O)N(C4=O)C6=CC=CC=C6
InChI
InChI=1S/C28H20N2O2/c1-2-29-23-16-10-9-15-20(23)24-21(18-11-5-3-6-12-18)17-22-25(26(24)29)28(32)30(27(22)31)19-13-7-4-8-14-19/h3-17H,2H2,1H3
InChIKey
MGJSOCZBAPNURK-UHFFFAOYSA-N
Compound name
10-ethyl-2,5-diphenylpyrrolo[3,4-a]carbazole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

416.15247 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.15975 204.3
[M+Na]+ 439.14169 215.7
[M-H]- 415.14519 215.6
[M+NH4]+ 434.18629 218.2
[M+K]+ 455.11563 206.7
[M+H-H2O]+ 399.14973 193.8
[M+HCOO]- 461.15067 223.2
[M+CH3COO]- 475.16632 214.6
[M+Na-2H]- 437.12714 203.6
[M]+ 416.15192 207.9
[M]- 416.15302 207.9
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.