CID 162396575

Dtxsid901032891

Structural Information

Molecular Formula
C8HF17O2P
SMILES
C(C(C(C(C(F)(F)[P+](=O)O)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C8F17O2P/c9-1(10,3(13,14)5(17,18)7(21,22)23)2(11,12)4(15,16)6(19,20)8(24,25)28(26)27/p+1
InChIKey
ZLRUNQSNWFTUTE-UHFFFAOYSA-O
Compound name
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl-hydroxy-oxophosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

482.94427 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 483.951546 178.8
[M+Na]+ 505.933488 182.7
[M-H]- 481.936994 187.1
[M+NH4]+ 500.978093 187.5
[M+K]+ 521.907428 187.3
[M+H-H2O]+ 465.941530 158.9
[M+HCOO]- 527.942471 200.2
[M+CH3COO]- 541.958121 226.3
[M+Na-2H]- 503.918936 174.9
[M]+ 482.94372142 173.2
[M]- 482.94481858 173.2
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.