CID 11156149

7:2 fluorotelomer dihydrogen phosphate

Structural Information

Molecular Formula
C9H6F15O4P
SMILES
C(COP(=O)(O)O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C9H6F15O4P/c10-3(11,1-2-28-29(25,26)27)4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)24/h1-2H2,(H2,25,26,27)
InChIKey
XXKFVYRCSDPCBZ-UHFFFAOYSA-N
Compound name
3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-pentadecafluorononyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

5
Patents

493.9764 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 494.98368 165.3
[M+Na]+ 516.96562 168.0
[M-H]- 492.96912 172.2
[M+NH4]+ 512.01022 172.5
[M+K]+ 532.93956 173.7
[M+H-H2O]+ 476.97366 147.3
[M+HCOO]- 538.97460 185.2
[M+CH3COO]- 552.99025 230.8
[M+Na-2H]- 514.95107 160.5
[M]+ 493.97585 161.9
[M]- 493.97695 161.9
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

patents stripe