CID 3326302

2,2,3,3,4,4,5,5,5-nonafluoro-n-(2-hydroxyethyl)pentanamide

Structural Information

Molecular Formula
C7H6F9NO2
SMILES
C(CO)NC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C7H6F9NO2/c8-4(9,3(19)17-1-2-18)5(10,11)6(12,13)7(14,15)16/h18H,1-2H2,(H,17,19)
InChIKey
KXCGGDSYTXMIML-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,5,5,5-nonafluoro-N-(2-hydroxyethyl)pentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.02548 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.03276 183.5
[M+Na]+ 330.01470 183.5
[M+NH4]+ 325.05930 182.4
[M+K]+ 345.98864 181.6
[M-H]- 306.01820 174.8
[M+Na-2H]- 328.00015 180.0
[M]+ 307.02493 180.6
[M]- 307.02603 180.6
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.