CID 4280657

N-ethyl-2,2,3,3,4,4,5,5,5-nonafluoropentanamide

Structural Information

Molecular Formula
C7H6F9NO
SMILES
CCNC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C7H6F9NO/c1-2-17-3(18)4(8,9)5(10,11)6(12,13)7(14,15)16/h2H2,1H3,(H,17,18)
InChIKey
BPUDDBGLNYFQPY-UHFFFAOYSA-N
Compound name
N-ethyl-2,2,3,3,4,4,5,5,5-nonafluoropentanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

291.03058 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.03786 151.5
[M+Na]+ 314.01980 159.6
[M-H]- 290.02330 141.0
[M+NH4]+ 309.06440 166.1
[M+K]+ 329.99374 157.5
[M+H-H2O]+ 274.02784 140.4
[M+HCOO]- 336.02878 159.5
[M+CH3COO]- 350.04443 203.3
[M+Na-2H]- 312.00525 155.1
[M]+ 291.03003 137.6
[M]- 291.03113 137.6
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.