CID 3088250

Alpha-(1,1'-biphenyl)-4-yl-alpha-(phenylmethyl)-2-benzofuranmethanol

Structural Information

Molecular Formula
C28H22O2
SMILES
C1=CC=C(C=C1)CC(C2=CC=C(C=C2)C3=CC=CC=C3)(C4=CC5=CC=CC=C5O4)O
InChI
InChI=1S/C28H22O2/c29-28(20-21-9-3-1-4-10-21,27-19-24-13-7-8-14-26(24)30-27)25-17-15-23(16-18-25)22-11-5-2-6-12-22/h1-19,29H,20H2
InChIKey
LXZJWSORIHGSMX-UHFFFAOYSA-N
Compound name
1-(1-benzofuran-2-yl)-2-phenyl-1-(4-phenylphenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

390.162 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.169276 195.5
[M+Na]+ 413.151218 202.6
[M-H]- 389.154724 208.4
[M+NH4]+ 408.195823 206.4
[M+K]+ 429.125158 196.1
[M+H-H2O]+ 373.159260 185.9
[M+HCOO]- 435.160201 215.5
[M+CH3COO]- 449.175851 205.6
[M+Na-2H]- 411.136666 200.8
[M]+ 390.16145142 196.4
[M]- 390.16254858 196.4
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.