CID 132398920

1-(2,2-difluorocyclopropyl)-1h-pyrazol-4-amine

Structural Information

Molecular Formula

C₆H₇F₂N₃

SMILES

C1C(C1(F)F)N2C=C(C=N2)N

InChI

InChI=1S/C6H7F2N3/c7-6(8)1-5(6)11-3-4(9)2-10-11/h2-3,5H,1,9H2

InChIKey

RHLZMATYLDITGM-UHFFFAOYSA-N

Compound name

1-(2,2-difluorocyclopropyl)pyrazol-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 159.0608 Da
Monoisotopic Mass: 0.3
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]+	160.06808	133.8
[M+Na]+	182.05002	144.0
[M+NH4]+	177.09462	142.1
[M+K]+	198.02396	140.8
[M-H]-	158.05352	139.6
[M+Na-2H]-	180.03547	142.3
[M]+	159.06025	137.7
[M]-	159.06135	137.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe