CID 145899188

2402837-33-4

Structural Information

Molecular Formula
C8H10F3N3
SMILES
C1CC1C2=NN(C=C2N)CC(F)(F)F
InChI
InChI=1S/C8H10F3N3/c9-8(10,11)4-14-3-6(12)7(13-14)5-1-2-5/h3,5H,1-2,4,12H2
InChIKey
MXPPWRLPDFYAPK-UHFFFAOYSA-N
Compound name
3-cyclopropyl-1-(2,2,2-trifluoroethyl)pyrazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.08269 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.08997 147.5
[M+Na]+ 228.07191 155.2
[M+NH4]+ 223.11651 152.8
[M+K]+ 244.04585 154.3
[M-H]- 204.07541 150.5
[M+Na-2H]- 226.05736 152.6
[M]+ 205.08214 149.9
[M]- 205.08324 149.9
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.