CID 9816843

Dihydrohonokiol

Structural Information

Molecular Formula
C18H20O2
SMILES
CCCC1=CC(=C(C=C1)O)C2=CC(=C(C=C2)O)CC=C
InChI
InChI=1S/C18H20O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h4,7-12,19-20H,2-3,5-6H2,1H3
InChIKey
IBKNHHZQPPUDQJ-UHFFFAOYSA-N
Compound name
2-(4-hydroxy-3-prop-2-enylphenyl)-4-propylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

59
Patents

268.14633 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.153606 163.2
[M+Na]+ 291.135548 171.2
[M-H]- 267.139054 167.6
[M+NH4]+ 286.180153 178.9
[M+K]+ 307.109488 165.2
[M+H-H2O]+ 251.143590 156.3
[M+HCOO]- 313.144531 183.8
[M+CH3COO]- 327.160181 196.9
[M+Na-2H]- 289.120996 165.4
[M]+ 268.14578142 163.7
[M]- 268.14687858 163.7
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

No patent data available for this compound.