CID 138394449

N-[3-(dimethylamino)propyl]perfluorododecanamide

Structural Information

Molecular Formula
C17H13F23N2O
SMILES
CN(C)CCCNC(=O)C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C17H13F23N2O/c1-42(2)5-3-4-41-6(43)7(18,19)8(20,21)9(22,23)10(24,25)11(26,27)12(28,29)13(30,31)14(32,33)15(34,35)16(36,37)17(38,39)40/h3-5H2,1-2H3,(H,41,43)
InChIKey
FPPMMZOESICKHH-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-tricosafluorododecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

698.06604 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 699.07332 152.7
[M+Na]+ 721.05526 152.7
[M+NH4]+ 716.09986 152.8
[M+K]+ 737.02920 152.8
[M-H]- 697.05876 152.7
[M+Na-2H]- 719.04071 152.7
[M]+ 698.06549 152.7
[M]- 698.06659 152.7
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.