CID 140387

Tris(4-fluorophenyl)phosphine

Structural Information

Molecular Formula
C18H12F3P
SMILES
C1=CC(=CC=C1F)P(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F
InChI
InChI=1S/C18H12F3P/c19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18/h1-12H
InChIKey
GEPJPYNDFSOARB-UHFFFAOYSA-N
Compound name
tris(4-fluorophenyl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1861
Patents

316.06287 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.070146 172.4
[M+Na]+ 339.052088 180.5
[M-H]- 315.055594 177.0
[M+NH4]+ 334.096693 186.8
[M+K]+ 355.026028 173.9
[M+H-H2O]+ 299.060130 158.5
[M+HCOO]- 361.061071 197.1
[M+CH3COO]- 375.076721 209.2
[M+Na-2H]- 337.037536 170.5
[M]+ 316.06232142 168.3
[M]- 316.06341858 168.3
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