CID 85639506

Dtxsid601032709

Structural Information

Molecular Formula
C10H10F9NO2
SMILES
CCN(CC1CO1)C(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10H10F9NO2/c1-2-20(3-5-4-22-5)6(21)7(11,12)8(13,14)9(15,16)10(17,18)19/h5H,2-4H2,1H3
InChIKey
DCBXCGZLFPIOOP-UHFFFAOYSA-N
Compound name
N-ethyl-2,2,3,3,4,4,5,5,5-nonafluoro-N-(oxiran-2-ylmethyl)pentanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

347.0568 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.06408 152.3
[M+Na]+ 370.04602 160.5
[M-H]- 346.04952 147.6
[M+NH4]+ 365.09062 159.5
[M+K]+ 386.01996 158.8
[M+H-H2O]+ 330.05406 139.4
[M+HCOO]- 392.05500 160.0
[M+CH3COO]- 406.07065 217.4
[M+Na-2H]- 368.03147 156.6
[M]+ 347.05625 144.7
[M]- 347.05735 144.7
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.