CID 122163515

1989659-42-8

Structural Information

Molecular Formula
C9H9F3N2O
SMILES
C1CCN2C(=NC(=C2C=O)C(F)(F)F)C1
InChI
InChI=1S/C9H9F3N2O/c10-9(11,12)8-6(5-15)14-4-2-1-3-7(14)13-8/h5H,1-4H2
InChIKey
CLUVZSBZVZFFNL-UHFFFAOYSA-N
Compound name
2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.0667 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.07398 148.9
[M+Na]+ 241.05592 156.8
[M+NH4]+ 236.10052 154.1
[M+K]+ 257.02986 153.6
[M-H]- 217.05942 144.4
[M+Na-2H]- 239.04137 150.6
[M]+ 218.06615 148.3
[M]- 218.06725 148.3
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

No patent data available for this compound.