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
1
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]+ 333.14205 174.2
[M+Na]+ 355.12399 177.9
[M-H]- 331.12749 171.8
[M+NH4]+ 350.16859 184.5
[M+K]+ 371.09793 173.3
[M+H-H2O]+ 315.13203 163.7
[M+HCOO]- 377.13297 185.6
[M+CH3COO]- 391.14862 204.6
[M+Na-2H]- 353.10944 174.9
[M]+ 332.13422 165.2
[M]- 332.13532 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.