CID 139594909

N,n,n-trimethyl-3-[methyl(perfluoroethanesulfonyl)amino]propan-1-aminium

Structural Information

Molecular Formula
C9H18F5N2O2S
SMILES
CN(CCC[N+](C)(C)C)S(=O)(=O)C(C(F)(F)F)(F)F
InChI
InChI=1S/C9H18F5N2O2S/c1-15(6-5-7-16(2,3)4)19(17,18)9(13,14)8(10,11)12/h5-7H2,1-4H3/q+1
InChIKey
FKAAEAHUKRGMBQ-UHFFFAOYSA-N
Compound name
trimethyl-[3-[methyl(1,1,2,2,2-pentafluoroethylsulfonyl)amino]propyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.10092 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.10820 169.6
[M+Na]+ 336.09014 172.8
[M+NH4]+ 331.13474 172.0
[M+K]+ 352.06408 170.3
[M-H]- 312.09364 162.7
[M+Na-2H]- 334.07559 169.1
[M]+ 313.10037 168.3
[M]- 313.10147 168.3
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.