CID 119009256

7-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde

Structural Information

Molecular Formula
C9H5F3N2O
SMILES
C1=CN2C(=NC=C2C=O)C=C1C(F)(F)F
InChI
InChI=1S/C9H5F3N2O/c10-9(11,12)6-1-2-14-7(5-15)4-13-8(14)3-6/h1-5H
InChIKey
QYZHRDSDGWCGLI-UHFFFAOYSA-N
Compound name
7-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

214.0354 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.042676 138.9
[M+Na]+ 237.024618 151.5
[M-H]- 213.028124 138.0
[M+NH4]+ 232.069223 158.2
[M+K]+ 252.998558 147.5
[M+H-H2O]+ 197.032660 129.9
[M+HCOO]- 259.033601 158.5
[M+CH3COO]- 273.049251 185.2
[M+Na-2H]- 235.010066 146.1
[M]+ 214.03485142 138.4
[M]- 214.03594858 138.4
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

patents stripe