CID 24892807

Dtxsid801196969

Structural Information

Molecular Formula
C15H10N2O3
SMILES
C1=CC=C2C(=C1)C=CC3=CC(=O)C(=O)C=C3N2C(=O)N
InChI
InChI=1S/C15H10N2O3/c16-15(20)17-11-4-2-1-3-9(11)5-6-10-7-13(18)14(19)8-12(10)17/h1-8H,(H2,16,20)
InChIKey
GONNJNYLBPEEPH-UHFFFAOYSA-N
Compound name
2,3-dioxobenzo[b][1]benzazepine-11-carboxamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

17
Patents

266.06915 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.076426 155.5
[M+Na]+ 289.058368 166.1
[M-H]- 265.061874 162.0
[M+NH4]+ 284.102973 172.0
[M+K]+ 305.032308 166.6
[M+H-H2O]+ 249.066410 149.6
[M+HCOO]- 311.067351 177.8
[M+CH3COO]- 325.083001 168.4
[M+Na-2H]- 287.043816 163.0
[M]+ 266.06860142 155.5
[M]- 266.06969858 155.5
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