CID 22912798

1-methyl-5-(trifluoromethyl)-1h-pyrazol-3-amine

Structural Information

Molecular Formula
C5H6F3N3
SMILES
CN1C(=CC(=N1)N)C(F)(F)F
InChI
InChI=1S/C5H6F3N3/c1-11-3(5(6,7)8)2-4(9)10-11/h2H,1H3,(H2,9,10)
InChIKey
XIVVMPWSYHAGFP-UHFFFAOYSA-N
Compound name
1-methyl-5-(trifluoromethyl)pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

143
Patents

165.05138 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.05866 133.5
[M+Na]+ 188.04060 141.1
[M+NH4]+ 183.08520 138.4
[M+K]+ 204.01454 139.1
[M-H]- 164.04410 129.2
[M+Na-2H]- 186.02605 136.4
[M]+ 165.05083 132.8
[M]- 165.05193 132.8
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

patents stripe