CID 6483872

126417-81-0

Structural Information

Molecular Formula

C₁₀H₁₀FN₃

SMILES

CN1C(=CC(=N1)C2=CC=C(C=C2)F)N

InChI

InChI=1S/C10H10FN3/c1-14-10(12)6-9(13-14)7-2-4-8(11)5-3-7/h2-6H,12H2,1H3

InChIKey

GHWUZPAXOSXMQB-UHFFFAOYSA-N

Compound name

5-(4-fluorophenyl)-2-methylpyrazol-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 52
Patents: 191.08588 Da
Monoisotopic Mass: 1.6
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]+	192.09316	139.9
[M+Na]+	214.07510	152.7
[M+NH4]+	209.11970	147.7
[M+K]+	230.04904	148.0
[M-H]-	190.07860	142.1
[M+Na-2H]-	212.06055	147.6
[M]+	191.08533	142.2
[M]-	191.08643	142.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe