CID 163198785

Koyktjbgtddhht-uhfffaoysa-n

Structural Information

Molecular Formula
C11H6F15NO2
SMILES
C(CNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C=O
InChI
InChI=1S/C11H6F15NO2/c12-5(13,4(29)27-2-1-3-28)6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)26/h3H,1-2H2,(H,27,29)
InChIKey
KOYKTJBGTDDHHT-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-N-(3-oxopropyl)octanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

469.0159 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 470.02318 170.6
[M+Na]+ 492.00512 170.5
[M+NH4]+ 487.04972 170.0
[M+K]+ 507.97906 170.2
[M-H]- 468.00862 167.8
[M+Na-2H]- 489.99057 169.9
[M]+ 469.01535 169.7
[M]- 469.01645 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

literature stripe

Patent stripe

No patent data available for this compound.