CID 139596925

N-[3-(dimethylamino)propyl]-perfluorohexanamide

Structural Information

Molecular Formula
C11H13F11N2O
SMILES
CN(C)CCCNC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C11H13F11N2O/c1-24(2)5-3-4-23-6(25)7(12,13)8(14,15)9(16,17)10(18,19)11(20,21)22/h3-5H2,1-2H3,(H,23,25)
InChIKey
RKCBASOCGZNLGO-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-2,2,3,3,4,4,5,5,6,6,6-undecafluorohexanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

398.08524 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.09252 177.5
[M+Na]+ 421.07446 184.0
[M-H]- 397.07796 165.9
[M+NH4]+ 416.11906 178.2
[M+K]+ 437.04840 182.1
[M+H-H2O]+ 381.08250 164.1
[M+HCOO]- 443.08344 184.7
[M+CH3COO]- 457.09909 228.8
[M+Na-2H]- 419.05991 179.0
[M]+ 398.08469 161.9
[M]- 398.08579 161.9
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.