CID 51358476

1093059-58-5

Structural Information

Molecular Formula

C₇H₆F₄N₂

SMILES

C1=CC(=C(C=C1C(F)(F)F)NN)F

InChI

InChI=1S/C7H6F4N2/c8-5-2-1-4(7(9,10)11)3-6(5)13-12/h1-3,13H,12H2

InChIKey

NHTBGXJERDIJGP-UHFFFAOYSA-N

Compound name

[2-fluoro-5-(trifluoromethyl)phenyl]hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 194.0467 Da
Monoisotopic Mass: 2.1
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]+	195.05398	133.5
[M+Na]+	217.03592	142.7
[M-H]-	193.03942	132.2
[M+NH4]+	212.08052	152.5
[M+K]+	233.00986	139.4
[M+H-H2O]+	177.04396	124.7
[M+HCOO]-	239.04490	154.2
[M+CH3COO]-	253.06055	187.5
[M+Na-2H]-	215.02137	139.1
[M]+	194.04615	125.5
[M]-	194.04725	125.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe