CID 16217793

2-(dimethylamino)-2'-bromo-1,1'-biphenyl

Structural Information

Molecular Formula

C₁₄H₁₄BrN

SMILES

CN(C)C1=CC=CC=C1C2=CC=CC=C2Br

InChI

InChI=1S/C14H14BrN/c1-16(2)14-10-6-4-8-12(14)11-7-3-5-9-13(11)15/h3-10H,1-2H3

InChIKey

AILIDRDRRAFKFA-UHFFFAOYSA-N

Compound name

2-(2-bromophenyl)-N,N-dimethylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 38
Patents: 275.03094 Da
Monoisotopic Mass: 4.4
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]+	276.03822	154.7
[M+Na]+	298.02016	165.3
[M-H]-	274.02366	165.2
[M+NH4]+	293.06476	175.0
[M+K]+	313.99410	154.3
[M+H-H2O]+	258.02820	153.4
[M+HCOO]-	320.02914	177.9
[M+CH3COO]-	334.04479	201.8
[M+Na-2H]-	296.00561	161.7
[M]+	275.03039	173.7
[M]-	275.03149	173.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe