CID 210146

Bg 11 je

Structural Information

Molecular Formula
C15H20F3NO
SMILES
CCCC(CCC)C(=O)NC1=CC=CC=C1C(F)(F)F
InChI
InChI=1S/C15H20F3NO/c1-3-7-11(8-4-2)14(20)19-13-10-6-5-9-12(13)15(16,17)18/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,19,20)
InChIKey
CMGMDSVVSQSHRF-UHFFFAOYSA-N
Compound name
2-propyl-N-[2-(trifluoromethyl)phenyl]pentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.1497 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.15698 170.0
[M+Na]+ 310.13892 177.0
[M+NH4]+ 305.18352 174.4
[M+K]+ 326.11286 171.6
[M-H]- 286.14242 166.8
[M+Na-2H]- 308.12437 172.4
[M]+ 287.14915 169.7
[M]- 287.15025 169.7
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

No patent data available for this compound.