CID 59003275

1578106-18-9

Structural Information

Molecular Formula
C8H13F3N2O
SMILES
C1CC(CNC1)CNC(=O)C(F)(F)F
InChI
InChI=1S/C8H13F3N2O/c9-8(10,11)7(14)13-5-6-2-1-3-12-4-6/h6,12H,1-5H2,(H,13,14)
InChIKey
IXPFZGASIYQZGR-UHFFFAOYSA-N
Compound name
2,2,2-trifluoro-N-(piperidin-3-ylmethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

210.09799 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.10527 144.1
[M+Na]+ 233.08721 148.2
[M-H]- 209.09071 139.9
[M+NH4]+ 228.13181 160.0
[M+K]+ 249.06115 145.7
[M+H-H2O]+ 193.09525 135.2
[M+HCOO]- 255.09619 157.5
[M+CH3COO]- 269.11184 183.5
[M+Na-2H]- 231.07266 147.3
[M]+ 210.09744 133.0
[M]- 210.09854 133.0
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