Tetrahydromagnolol

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Systematic / IUPAC Name: 5,5'-Dipropyl-2,2'-biphenyldiol

ID: Reference5846

Other Names: Magnolignan;
(1,1'-Biphenyl)-2,2'-diol, 5,5'-dipropyl- ;
2-(2-Hydroxy-5-propylphenyl)-4-propylphenol

Formula: C18H22O2

Class: Endogenous Metabolites

Spectral Data

Tetrahydromagnolol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/27/2016 11:38:00 AM
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Identificators

InChI InChI=1S/C18H22O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h7-12,19-20H,3-6H2,1-2H3
InChI Key OYAQUBKYAKSHOA-UHFFFAOYSA-N
Canonical SMILES CCCC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)CCC)O
CAS 20601858
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Other Names Magnolignan;
(1,1'-Biphenyl)-2,2'-diol, 5,5'-dipropyl- ;
2-(2-Hydroxy-5-propylphenyl)-4-propylphenol

In Other Databases

KEGG D09209
ChemSpider 4479487
ChEMBL CHEMBL32362
PubChem 5321851