CID 3668137

2,2,3,3,4,4,5,5,5-nonafluoro-n-phenylpentanamide

Structural Information

Molecular Formula
C11H6F9NO
SMILES
C1=CC=C(C=C1)NC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C11H6F9NO/c12-8(13,7(22)21-6-4-2-1-3-5-6)9(14,15)10(16,17)11(18,19)20/h1-5H,(H,21,22)
InChIKey
TUKGKGYCBQOMNC-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5,5-nonafluoro-N-phenylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.03058 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.03786 183.3
[M+Na]+ 362.01980 184.4
[M+NH4]+ 357.06440 182.8
[M+K]+ 377.99374 181.9
[M-H]- 338.02330 176.1
[M+Na-2H]- 360.00525 181.7
[M]+ 339.03003 181.1
[M]- 339.03113 181.1
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.