CID 2827955

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-1-(piperidin-1-yl)propan-1-one

Structural Information

Molecular Formula
C14H10F17NO3
SMILES
C1CCN(CC1)C(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F
InChI
InChI=1S/C14H10F17NO3/c15-7(10(19,20)21,6(33)32-4-2-1-3-5-32)34-14(30,31)9(18,12(25,26)27)35-13(28,29)8(16,17)11(22,23)24/h1-5H2
InChIKey
NAAVGJAQOMZPSW-UHFFFAOYSA-N
Compound name
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]-1-piperidin-1-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

563.03894 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 564.04622 161.3
[M+Na]+ 586.02816 161.3
[M+NH4]+ 581.07276 161.0
[M+K]+ 602.00210 161.7
[M-H]- 562.03166 159.8
[M+Na-2H]- 584.01361 161.6
[M]+ 563.03839 160.8
[M]- 563.03949 160.8
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.