CID 4366893

99665-68-6

Structural Information

Molecular Formula
C14H9F6P
SMILES
C1=CC(=CC=C1C(F)(F)F)PC2=CC=C(C=C2)C(F)(F)F
InChI
InChI=1S/C14H9F6P/c15-13(16,17)9-1-5-11(6-2-9)21-12-7-3-10(4-8-12)14(18,19)20/h1-8,21H
InChIKey
LLJITAAISCMRAR-UHFFFAOYSA-N
Compound name
bis[4-(trifluoromethyl)phenyl]phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

152
Patents

322.0346 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.04188 171.1
[M+Na]+ 345.02382 180.4
[M-H]- 321.02732 169.1
[M+NH4]+ 340.06842 185.8
[M+K]+ 360.99776 174.5
[M+H-H2O]+ 305.03186 156.7
[M+HCOO]- 367.03280 190.5
[M+CH3COO]- 381.04845 207.6
[M+Na-2H]- 343.00927 171.0
[M]+ 322.03405 163.7
[M]- 322.03515 163.7
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.