CID 44151856

93803-60-2

Structural Information

Molecular Formula
C32H46O2
SMILES
CC(C)C1=CC(=C(C(=C1)C(C2=CC(=CC(=C2O)C3CCCC3)C(C)C)C(C)C)O)C4CCCC4
InChI
InChI=1S/C32H46O2/c1-19(2)24-15-26(22-11-7-8-12-22)31(33)28(17-24)30(21(5)6)29-18-25(20(3)4)16-27(32(29)34)23-13-9-10-14-23/h15-23,30,33-34H,7-14H2,1-6H3
InChIKey
GUQPPJSPZYSPPS-UHFFFAOYSA-N
Compound name
2-cyclopentyl-6-[1-(3-cyclopentyl-2-hydroxy-5-propan-2-ylphenyl)-2-methylpropyl]-4-propan-2-ylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

462.3498 Da
Monoisotopic Mass

10.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 463.35708 220.6
[M+Na]+ 485.33902 220.4
[M-H]- 461.34252 229.6
[M+NH4]+ 480.38362 230.8
[M+K]+ 501.31296 214.9
[M+H-H2O]+ 445.34706 213.2
[M+HCOO]- 507.34800 230.6
[M+CH3COO]- 521.36365 238.1
[M+Na-2H]- 483.32447 205.4
[M]+ 462.34925 215.8
[M]- 462.35035 215.8
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.