CID 101150317

Perfluorodecane amido amine oxide

Structural Information

Molecular Formula
C15H13F19N2O2
SMILES
C[N+](C)(CCCNC(=O)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)[O-]
InChI
InChI=1S/C15H13F19N2O2/c1-36(2,38)5-3-4-35-6(37)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)12(26,27)13(28,29)14(30,31)15(32,33)34/h3-5H2,1-2H3,(H,35,37)
InChIKey
HXBLIUWSVJMHNO-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecanoylamino)propan-1-amine oxide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

614.0674 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 615.07468 210.0
[M+Na]+ 637.05662 214.3
[M-H]- 613.06012 222.1
[M+NH4]+ 632.10122 221.0
[M+K]+ 653.03056 226.9
[M+H-H2O]+ 597.06466 189.5
[M+HCOO]- 659.06560 226.6
[M+CH3COO]- 673.08125 251.7
[M+Na-2H]- 635.04207 206.4
[M]+ 614.06685 203.8
[M]- 614.06795 203.8
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.