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]+ 463.357076 220.6
[M+Na]+ 485.339018 220.4
[M-H]- 461.342524 229.6
[M+NH4]+ 480.383623 230.8
[M+K]+ 501.312958 214.9
[M+H-H2O]+ 445.347060 213.2
[M+HCOO]- 507.348001 230.6
[M+CH3COO]- 521.363651 238.1
[M+Na-2H]- 483.324466 205.4
[M]+ 462.34925142 215.8
[M]- 462.35034858 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.