CID 23334386

Dtxsid601376088

Structural Information

Molecular Formula

C₈H₁₁BrN₂

SMILES

C1=CC(=CC=C1CCNN)Br

InChI

InChI=1S/C8H11BrN2/c9-8-3-1-7(2-4-8)5-6-11-10/h1-4,11H,5-6,10H2

InChIKey

NYYBSRBAMXVFQR-UHFFFAOYSA-N

Compound name

2-(4-bromophenyl)ethylhydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 214.01056 Da
Monoisotopic Mass: 1.7
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]+	215.01784	138.2
[M+Na]+	236.99978	148.1
[M-H]-	213.00328	143.7
[M+NH4]+	232.04438	159.5
[M+K]+	252.97372	136.3
[M+H-H2O]+	197.00782	137.0
[M+HCOO]-	259.00876	161.5
[M+CH3COO]-	273.02441	188.6
[M+Na-2H]-	234.98523	146.3
[M]+	214.01001	154.0
[M]-	214.01111	154.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.