CID 66838044

94994-62-4

Structural Information

Molecular Formula

C₁₈H₁₂BrN

SMILES

C1=CC=C(C=C1)N2C3=CC=CC=C3C4=C2C=C(C=C4)Br

InChI

InChI=1S/C18H12BrN/c19-13-10-11-16-15-8-4-5-9-17(15)20(18(16)12-13)14-6-2-1-3-7-14/h1-12H

InChIKey

SOODLDGRGXOSTA-UHFFFAOYSA-N

Compound name

2-bromo-9-phenylcarbazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1147
Patents: 321.01532 Da
Monoisotopic Mass: 5.7
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]+	322.02260	169.5
[M+Na]+	344.00454	183.3
[M-H]-	320.00804	179.9
[M+NH4]+	339.04914	190.1
[M+K]+	359.97848	170.1
[M+H-H2O]+	304.01258	168.6
[M+HCOO]-	366.01352	190.4
[M+CH3COO]-	380.02917	184.1
[M+Na-2H]-	341.98999	177.4
[M]+	321.01477	189.6
[M]-	321.01587	189.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe