CID 71330274

94190-72-4

Structural Information

Molecular Formula
C24H19F9P
SMILES
C1=CC=C(C=C1)[P+](CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C24H19F9P/c25-21(26,22(27,28)23(29,30)24(31,32)33)16-17-34(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17H2/q+1
InChIKey
UPLJOTUOAUFMKP-UHFFFAOYSA-N
Compound name
3,3,4,4,5,5,6,6,6-nonafluorohexyl(triphenyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

509.10806 Da
Monoisotopic Mass

8.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 510.11534 221.5
[M+Na]+ 532.09728 226.9
[M-H]- 508.10078 218.0
[M+NH4]+ 527.14188 226.9
[M+K]+ 548.07122 213.7
[M+H-H2O]+ 492.10532 205.1
[M+HCOO]- 554.10626 230.0
[M+CH3COO]- 568.12191 234.0
[M+Na-2H]- 530.08273 224.5
[M]+ 509.10751 207.4
[M]- 509.10861 207.4
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.