CID 3083562

Schembl21906332

Structural Information

Molecular Formula
C15H9F24P
SMILES
C(C(C(C(C(F)F)(F)F)(F)F)(F)F)P(CC(C(C(C(F)F)(F)F)(F)F)(F)F)CC(C(C(C(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C15H9F24P/c16-4(17)10(28,29)13(34,35)7(22,23)1-40(2-8(24,25)14(36,37)11(30,31)5(18)19)3-9(26,27)15(38,39)12(32,33)6(20)21/h4-6H,1-3H2
InChIKey
DISHTLVXZWCKIV-UHFFFAOYSA-N
Compound name
tris(2,2,3,3,4,4,5,5-octafluoropentyl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

676.00586 Da
Monoisotopic Mass

8.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 677.01314 212.8
[M+Na]+ 698.99508 217.6
[M-H]- 674.99858 221.2
[M+NH4]+ 694.03968 225.7
[M+K]+ 714.96902 230.0
[M+H-H2O]+ 659.00312 198.3
[M+HCOO]- 721.00406 222.6
[M+CH3COO]- 735.01971 265.2
[M+Na-2H]- 696.98053 210.1
[M]+ 676.00531 205.6
[M]- 676.00641 205.6
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