CID 3623729

2,4,6-triphenylphenol

Structural Information

Molecular Formula
C24H18O
SMILES
C1=CC=C(C=C1)C2=CC(=C(C(=C2)C3=CC=CC=C3)O)C4=CC=CC=C4
InChI
InChI=1S/C24H18O/c25-24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20/h1-17,25H
InChIKey
OKFLKUZAJUNRDN-UHFFFAOYSA-N
Compound name
2,4,6-triphenylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

670
Patents

322.13577 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.14305 178.2
[M+Na]+ 345.12499 185.2
[M-H]- 321.12849 189.3
[M+NH4]+ 340.16959 190.6
[M+K]+ 361.09893 177.6
[M+H-H2O]+ 305.13303 167.9
[M+HCOO]- 367.13397 200.0
[M+CH3COO]- 381.14962 188.9
[M+Na-2H]- 343.11044 182.8
[M]+ 322.13522 175.6
[M]- 322.13632 175.6
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