CID 130889631

4-fluoro-1-methyl-1h-pyrazol-3-amine

Structural Information

Molecular Formula
C4H6FN3
SMILES
CN1C=C(C(=N1)N)F
InChI
InChI=1S/C4H6FN3/c1-8-2-3(5)4(6)7-8/h2H,1H3,(H2,6,7)
InChIKey
RNJOFCSXDPWONK-UHFFFAOYSA-N
Compound name
4-fluoro-1-methylpyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

115.05457 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.06185 117.7
[M+Na]+ 138.04379 128.3
[M-H]- 114.04729 117.8
[M+NH4]+ 133.08839 139.5
[M+K]+ 154.01773 126.9
[M+H-H2O]+ 98.051830 110.5
[M+HCOO]- 160.05277 141.4
[M+CH3COO]- 174.06842 170.7
[M+Na-2H]- 136.02924 123.6
[M]+ 115.05402 115.4
[M]- 115.05512 115.4
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.