CID 66585247

5-bromo-7h-benzo[c]carbazole

Structural Information

Molecular Formula

C₁₆H₁₀BrN

SMILES

C1=CC=C2C(=C1)C(=CC3=C2C4=CC=CC=C4N3)Br

InChI

InChI=1S/C16H10BrN/c17-13-9-15-16(11-6-2-1-5-10(11)13)12-7-3-4-8-14(12)18-15/h1-9,18H

InChIKey

KNJJGSGPSKPDBR-UHFFFAOYSA-N

Compound name

5-bromo-7H-benzo[c]carbazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 59
Patents: 294.99966 Da
Monoisotopic Mass: 5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	296.006936	160.9
[M+Na]+	317.988878	176.1
[M-H]-	293.992384	168.5
[M+NH4]+	313.033483	183.2
[M+K]+	333.962818	162.3
[M+H-H2O]+	277.996920	161.0
[M+HCOO]-	339.997861	180.9
[M+CH3COO]-	354.013511	175.9
[M+Na-2H]-	315.974326	171.0
[M]+	294.99911142	181.3
[M]-	295.00020858	181.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe