CID 89165396

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

Structural Information

Molecular Formula
C3H4FN3
SMILES
C1=NNC(=C1F)N
InChI
InChI=1S/C3H4FN3/c4-2-1-6-7-3(2)5/h1H,(H3,5,6,7)
InChIKey
ORLRTNMBWQIKSI-UHFFFAOYSA-N
Compound name
4-fluoro-1H-pyrazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

33
Patents

101.038925 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.04620 113.8
[M+Na]+ 124.02814 123.4
[M-H]- 100.03165 112.3
[M+NH4]+ 119.07275 135.0
[M+K]+ 140.00208 121.4
[M+H-H2O]+ 84.036185 106.6
[M+HCOO]- 146.03713 136.3
[M+CH3COO]- 160.05278 164.0
[M+Na-2H]- 122.01359 120.4
[M]+ 101.03838 108.9
[M]- 101.03947 108.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe