CID 67919

Perfluorooctanamide

Structural Information

Molecular Formula
C8H2F15NO
SMILES
C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)N
InChI
InChI=1S/C8H2F15NO/c9-2(10,1(24)25)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)23/h(H2,24,25)
InChIKey
UGMUDSKJLAUMTC-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

194
Patents

412.9897 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.99698 174.4
[M+Na]+ 435.97892 183.2
[M-H]- 411.98242 157.6
[M+NH4]+ 431.02352 157.4
[M+K]+ 451.95286 180.2
[M+H-H2O]+ 395.98696 160.1
[M+HCOO]- 457.98790 168.1
[M+CH3COO]- 472.00355 225.2
[M+Na-2H]- 433.96437 176.5
[M]+ 412.98915 146.4
[M]- 412.99025 146.4
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.