CID 3055232

Picolinamide, 5-(alpha,alpha,alpha-trifluoro-o-tolyloxy)-

Structural Information

Molecular Formula
C13H9F3N2O2
SMILES
C1=CC=C(C(=C1)C(F)(F)F)OC2=CN=C(C=C2)C(=O)N
InChI
InChI=1S/C13H9F3N2O2/c14-13(15,16)9-3-1-2-4-11(9)20-8-5-6-10(12(17)19)18-7-8/h1-7H,(H2,17,19)
InChIKey
OCYOPQMIQQOESK-UHFFFAOYSA-N
Compound name
5-[2-(trifluoromethyl)phenoxy]pyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

282.0616 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.06888 158.8
[M+Na]+ 305.05082 167.4
[M-H]- 281.05432 160.2
[M+NH4]+ 300.09542 172.5
[M+K]+ 321.02476 163.2
[M+H-H2O]+ 265.05886 148.1
[M+HCOO]- 327.05980 177.3
[M+CH3COO]- 341.07545 200.2
[M+Na-2H]- 303.03627 163.1
[M]+ 282.06105 154.6
[M]- 282.06215 154.6
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