CID 171035980

1-ethyl-4-fluoro-1h-pyrazol-5-amine

Structural Information

Molecular Formula
C5H8FN3
SMILES
CCN1C(=C(C=N1)F)N
InChI
InChI=1S/C5H8FN3/c1-2-9-5(7)4(6)3-8-9/h3H,2,7H2,1H3
InChIKey
MBZRZVJTWAXVKA-UHFFFAOYSA-N
Compound name
1-ethyl-4-fluoropyrazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

129.07022 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.077496 122.4
[M+Na]+ 152.059438 132.5
[M-H]- 128.062944 122.3
[M+NH4]+ 147.104043 143.6
[M+K]+ 168.033378 130.8
[M+H-H2O]+ 112.067480 114.9
[M+HCOO]- 174.068421 145.7
[M+CH3COO]- 188.084071 173.8
[M+Na-2H]- 150.044886 127.7
[M]+ 129.06967142 120.4
[M]- 129.07076858 120.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.