CID 3020611

85338-47-2

Structural Information

Molecular Formula
C26H22O
SMILES
C1=CC=C(C=C1)CC2=CC=CC=C2C3=CC(=C(C=C3)O)CC4=CC=CC=C4
InChI
InChI=1S/C26H22O/c27-26-16-15-23(19-24(26)18-21-11-5-2-6-12-21)25-14-8-7-13-22(25)17-20-9-3-1-4-10-20/h1-16,19,27H,17-18H2
InChIKey
FMUWLBYSIFCENA-UHFFFAOYSA-N
Compound name
2-benzyl-4-(2-benzylphenyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.16705 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.17433 187.2
[M+Na]+ 373.15627 193.3
[M-H]- 349.15977 197.9
[M+NH4]+ 368.20087 198.4
[M+K]+ 389.13021 185.2
[M+H-H2O]+ 333.16431 176.4
[M+HCOO]- 395.16525 208.3
[M+CH3COO]- 409.18090 196.9
[M+Na-2H]- 371.14172 190.6
[M]+ 350.16650 185.2
[M]- 350.16760 185.2
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.