CID 13913421

110499-66-6

Structural Information

Molecular Formula

C₇H₅ClF₄N₂

SMILES

C1=C(C=C(C(=C1F)NN)Cl)C(F)(F)F

InChI

InChI=1S/C7H5ClF4N2/c8-4-1-3(7(10,11)12)2-5(9)6(4)14-13/h1-2,14H,13H2

InChIKey

LDEAIXDNMCHKOF-UHFFFAOYSA-N

Compound name

[2-chloro-6-fluoro-4-(trifluoromethyl)phenyl]hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 59
Patents: 228.00774 Da
Monoisotopic Mass: 2.8
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]+	229.01502	139.4
[M+Na]+	250.99696	150.2
[M-H]-	227.00046	138.2
[M+NH4]+	246.04156	158.1
[M+K]+	266.97090	145.0
[M+H-H2O]+	211.00500	131.6
[M+HCOO]-	273.00594	155.6
[M+CH3COO]-	287.02159	192.5
[M+Na-2H]-	248.98241	143.8
[M]+	228.00719	133.9
[M]-	228.00829	133.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe