CID 79717

5613-46-7

Structural Information

Molecular Formula
C19H24O2
SMILES
CC1=CC(=CC(=C1O)C)C(C)(C)C2=CC(=C(C(=C2)C)O)C
InChI
InChI=1S/C19H24O2/c1-11-7-15(8-12(2)17(11)20)19(5,6)16-9-13(3)18(21)14(4)10-16/h7-10,20-21H,1-6H3
InChIKey
ODJUOZPKKHIEOZ-UHFFFAOYSA-N
Compound name
4-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-2,6-dimethylphenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

31637
Patents

284.17764 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.18492 170.0
[M+Na]+ 307.16686 184.9
[M+NH4]+ 302.21146 177.9
[M+K]+ 323.14080 178.0
[M-H]- 283.17036 173.8
[M+Na-2H]- 305.15231 177.0
[M]+ 284.17709 173.5
[M]- 284.17819 173.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe