CID 2778005

4,4',4''-trifluorotrityl alcohol

Structural Information

Molecular Formula
C19H13F3O
SMILES
C1=CC(=CC=C1C(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)O)F
InChI
InChI=1S/C19H13F3O/c20-16-7-1-13(2-8-16)19(23,14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,23H
InChIKey
JALVMPWRAMMHQY-UHFFFAOYSA-N
Compound name
tris(4-fluorophenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

314.09186 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.09914 170.1
[M+Na]+ 337.08108 178.9
[M-H]- 313.08458 175.0
[M+NH4]+ 332.12568 183.6
[M+K]+ 353.05502 171.9
[M+H-H2O]+ 297.08912 159.2
[M+HCOO]- 359.09006 187.9
[M+CH3COO]- 373.10571 204.4
[M+Na-2H]- 335.06653 174.0
[M]+ 314.09131 165.2
[M]- 314.09241 165.2
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