CID 15055937

Ns00116668

Structural Information

Molecular Formula
C15H19F3N2O3
SMILES
C1CCNC(C1)CNC(=O)C2=C(C=CC(=C2)OCC(F)(F)F)O
InChI
InChI=1S/C15H19F3N2O3/c16-15(17,18)9-23-11-4-5-13(21)12(7-11)14(22)20-8-10-3-1-2-6-19-10/h4-5,7,10,19,21H,1-3,6,8-9H2,(H,20,22)
InChIKey
FNWQOVVWANCDDT-UHFFFAOYSA-N
Compound name
2-hydroxy-N-(piperidin-2-ylmethyl)-5-(2,2,2-trifluoroethoxy)benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

332.13477 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.142046 174.2
[M+Na]+ 355.123988 177.9
[M-H]- 331.127494 171.8
[M+NH4]+ 350.168593 184.5
[M+K]+ 371.097928 173.3
[M+H-H2O]+ 315.132030 163.7
[M+HCOO]- 377.132971 185.6
[M+CH3COO]- 391.148621 204.6
[M+Na-2H]- 353.109436 174.9
[M]+ 332.13422142 165.2
[M]- 332.13531858 165.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.