CID 71377731

Ns00114930

Structural Information

Molecular Formula
C15H25F9N
SMILES
CCC[N+](CCC)(CCC)CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C15H25F9N/c1-4-8-25(9-5-2,10-6-3)11-7-12(16,17)13(18,19)14(20,21)15(22,23)24/h4-11H2,1-3H3/q+1
InChIKey
WIWXQAJUJWSYJL-UHFFFAOYSA-N
Compound name
3,3,4,4,5,5,6,6,6-nonafluorohexyl(tripropyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

390.18433 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.19161 181.6
[M+Na]+ 413.17355 187.5
[M-H]- 389.17705 191.8
[M+NH4]+ 408.21815 196.3
[M+K]+ 429.14749 179.1
[M+H-H2O]+ 373.18159 172.3
[M+HCOO]- 435.18253 214.0
[M+CH3COO]- 449.19818 222.3
[M+Na-2H]- 411.15900 186.9
[M]+ 390.18378 170.2
[M]- 390.18488 170.2
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.