CID 94766

Benzopinacol

Structural Information

Molecular Formula
C26H22O2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O
InChI
InChI=1S/C26H22O2/c27-25(21-13-5-1-6-14-21,22-15-7-2-8-16-22)26(28,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,27-28H
InChIKey
MFEWNFVBWPABCX-UHFFFAOYSA-N
Compound name
1,1,2,2-tetraphenylethane-1,2-diol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

6
References

5866
Patents

366.162 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.16928 193.4
[M+Na]+ 389.15122 209.9
[M+NH4]+ 384.19582 202.1
[M+K]+ 405.12516 200.4
[M-H]- 365.15472 201.6
[M+Na-2H]- 387.13667 207.7
[M]+ 366.16145 198.6
[M]- 366.16255 198.6
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