CID 6454783

2,2'-methylenebis(6-cyclopentyl-p-cresol)

Structural Information

Molecular Formula
C25H32O2
SMILES
CC1=CC(=C(C(=C1)C2CCCC2)O)CC3=C(C(=CC(=C3)C)C4CCCC4)O
InChI
InChI=1S/C25H32O2/c1-16-11-20(24(26)22(13-16)18-7-3-4-8-18)15-21-12-17(2)14-23(25(21)27)19-9-5-6-10-19/h11-14,18-19,26-27H,3-10,15H2,1-2H3
InChIKey
IZJOSLLELCZERT-UHFFFAOYSA-N
Compound name
2-cyclopentyl-6-[(3-cyclopentyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

364.24023 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.24751 191.4
[M+Na]+ 387.22945 196.0
[M-H]- 363.23295 201.6
[M+NH4]+ 382.27405 206.2
[M+K]+ 403.20339 189.2
[M+H-H2O]+ 347.23749 184.2
[M+HCOO]- 409.23843 208.0
[M+CH3COO]- 423.25408 200.6
[M+Na-2H]- 385.21490 184.1
[M]+ 364.23968 186.7
[M]- 364.24078 186.7
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

patents stripe