CID 103863155

2369752-80-5

Structural Information

Molecular Formula

C₆H₆BrFN₂

SMILES

C1=CC(=C(C(=C1)Br)F)NN

InChI

InChI=1S/C6H6BrFN2/c7-4-2-1-3-5(10-9)6(4)8/h1-3,10H,9H2

InChIKey

VAZDHKAJTHGLHB-UHFFFAOYSA-N

Compound name

(3-bromo-2-fluorophenyl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 40
Patents: 203.96983 Da
Monoisotopic Mass: 2.0
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]+	204.97711	132.6
[M+Na]+	226.95905	144.3
[M-H]-	202.96255	137.6
[M+NH4]+	222.00365	154.5
[M+K]+	242.93299	132.5
[M+H-H2O]+	186.96709	131.1
[M+HCOO]-	248.96803	155.6
[M+CH3COO]-	262.98368	186.6
[M+Na-2H]-	224.94450	140.5
[M]+	203.96928	147.0
[M]-	203.97038	147.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe