CID 62290450

[6-(2,2,2-trifluoroethoxy)pyridin-2-yl]methanamine

Structural Information

Molecular Formula
C8H9F3N2O
SMILES
C1=CC(=NC(=C1)OCC(F)(F)F)CN
InChI
InChI=1S/C8H9F3N2O/c9-8(10,11)5-14-7-3-1-2-6(4-12)13-7/h1-3H,4-5,12H2
InChIKey
FEKKEZOYDREICU-UHFFFAOYSA-N
Compound name
[6-(2,2,2-trifluoroethoxy)pyridin-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

206.0667 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.07398 143.1
[M+Na]+ 229.05592 151.5
[M+NH4]+ 224.10052 148.2
[M+K]+ 245.02986 146.9
[M-H]- 205.05942 139.9
[M+Na-2H]- 227.04137 147.3
[M]+ 206.06615 143.0
[M]- 206.06725 143.0
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