CID 24839463

8-bromo-10-chloro-11h-indeno(1,2-b)quinolin-11-one

Structural Information

Molecular Formula
C16H7BrClNO
SMILES
C1=CC=C2C(=C1)C3=NC4=C(C=C(C=C4)Br)C(=C3C2=O)Cl
InChI
InChI=1S/C16H7BrClNO/c17-8-5-6-12-11(7-8)14(18)13-15(19-12)9-3-1-2-4-10(9)16(13)20/h1-7H
InChIKey
DMMQHYGZVWDZJU-UHFFFAOYSA-N
Compound name
8-bromo-10-chloroindeno[1,2-b]quinolin-11-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.93994 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.94722 170.7
[M+Na]+ 365.92916 187.1
[M-H]- 341.93266 179.2
[M+NH4]+ 360.97376 192.8
[M+K]+ 381.90310 172.9
[M+H-H2O]+ 325.93720 171.0
[M+HCOO]- 387.93814 185.3
[M+CH3COO]- 401.95379 185.5
[M+Na-2H]- 363.91461 177.5
[M]+ 342.93939 193.4
[M]- 342.94049 193.4
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.