CID 3231306

2-(trifluoromethyl)imidazo[1,2-a]pyrazine

Structural Information

Molecular Formula
C7H4F3N3
SMILES
C1=CN2C=C(N=C2C=N1)C(F)(F)F
InChI
InChI=1S/C7H4F3N3/c8-7(9,10)5-4-13-2-1-11-3-6(13)12-5/h1-4H
InChIKey
GZOZMIOBJGXNBA-UHFFFAOYSA-N
Compound name
2-(trifluoromethyl)imidazo[1,2-a]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

114
Patents

187.03574 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.043016 132.1
[M+Na]+ 210.024958 144.5
[M-H]- 186.028464 129.7
[M+NH4]+ 205.069563 151.0
[M+K]+ 225.998898 140.8
[M+H-H2O]+ 170.033000 122.3
[M+HCOO]- 232.033941 150.7
[M+CH3COO]- 246.049591 179.8
[M+Na-2H]- 208.010406 141.0
[M]+ 187.03519142 130.3
[M]- 187.03628858 130.3
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