CID 136200

4-(trifluoromethyl)phenylhydrazine

Structural Information

Molecular Formula

C₇H₇F₃N₂

SMILES

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

InChI

InChI=1S/C7H7F3N2/c8-7(9,10)5-1-3-6(12-11)4-2-5/h1-4,12H,11H2

InChIKey

DBNLGTYGKCMLLR-UHFFFAOYSA-N

Compound name

[4-(trifluoromethyl)phenyl]hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1109
Patents: 176.05614 Da
Monoisotopic Mass: 2.4
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]+	177.06342	130.7
[M+Na]+	199.04536	138.9
[M-H]-	175.04886	130.4
[M+NH4]+	194.08996	150.2
[M+K]+	215.01930	136.1
[M+H-H2O]+	159.05340	122.7
[M+HCOO]-	221.05434	152.6
[M+CH3COO]-	235.06999	183.4
[M+Na-2H]-	197.03081	137.6
[M]+	176.05559	123.6
[M]-	176.05669	123.6

Literature stripe

literature stripe

Patent stripe

patents stripe