CID 78757

Bis(pentafluorophenyl)phenylphosphine

Structural Information

Molecular Formula
C18H5F10P
SMILES
C1=CC=C(C=C1)P(C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F
InChI
InChI=1S/C18H5F10P/c19-7-9(21)13(25)17(14(26)10(7)22)29(6-4-2-1-3-5-6)18-15(27)11(23)8(20)12(24)16(18)28/h1-5H
InChIKey
OYNXPGGNQMSMTR-UHFFFAOYSA-N
Compound name
bis(2,3,4,5,6-pentafluorophenyl)-phenylphosphane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

391
Patents

441.99692 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 443.00420 195.6
[M+Na]+ 464.98614 210.3
[M-H]- 440.98964 193.4
[M+NH4]+ 460.03074 206.1
[M+K]+ 480.96008 200.9
[M+H-H2O]+ 424.99418 176.3
[M+HCOO]- 486.99512 211.9
[M+CH3COO]- 501.01077 236.5
[M+Na-2H]- 462.97159 184.5
[M]+ 441.99637 186.1
[M]- 441.99747 186.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe