CID 25764

13181-50-5

Structural Information

Molecular Formula

C₉H₁₁BrN₂

SMILES

CN(C)C=NC1=CC=C(C=C1)Br

InChI

InChI=1S/C9H11BrN2/c1-12(2)7-11-9-5-3-8(10)4-6-9/h3-7H,1-2H3

InChIKey

OJKJZQJONGTMRZ-UHFFFAOYSA-N

Compound name

N'-(4-bromophenyl)-N,N-dimethylmethanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 226.01056 Da
Monoisotopic Mass: 2.3
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]+	227.01784	140.1
[M+Na]+	248.99978	143.2
[M+NH4]+	244.04438	145.7
[M+K]+	264.97372	142.4
[M-H]-	225.00328	142.7
[M+Na-2H]-	246.98523	145.2
[M]+	226.01001	140.1
[M]-	226.01111	140.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.