(-)-CP-47,497

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Systematic / IUPAC Name: 2-[(1S,3R)-3-Hydroxycyclohexyl]-5-(2-methyloctan-2-yl)phenol

ID: Reference3142

Other Names: 2-[(1S,3R)-3-Hydroxycyclohexyl]-5-(2-methyloctan-2-yl)phenol ;
5-(1,1-Dimethyl-heptyl)-2-(3-hydroxy-cyclohexyl)-phenol;
Phenol, 5-(1,1-dimethylheptyl)-2-[(1S,3R)-3-hydroxycyclohexyl]-;
CP 47.497 ;
CP 47497

Formula: C21H34O2

Class: Drugs of Abuse/Illegal Drugs Sports Doping Drugs

Spectral Data

(-)-CP-47,497 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 Plus Orbitrap
No. of Spectral Trees 5
No. of Spectra 487
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/23/2017 8:46:20 AM
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Identificators

InChI InChI=1S/C21H34O2/c1-4-5-6-7-13-21(2,3)17-11-12-19(20(23)15-17)16-9-8-10-18(22)14-16/h11-12,15-16,18,22-23H,4-10,13-14H2,1-3H3/t16-,18+/m0/s1
InChI Key ZWWRREXSUJTKNN-FUHWJXTLSA-N
Canonical SMILES CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCC(C2)O)O
CAS 114753514
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Other Names 2-[(1S,3R)-3-Hydroxycyclohexyl]-5-(2-methyloctan-2-yl)phenol ;
5-(1,1-Dimethyl-heptyl)-2-(3-hydroxy-cyclohexyl)-phenol;
Phenol, 5-(1,1-dimethylheptyl)-2-[(1S,3R)-3-hydroxycyclohexyl]-;
CP 47.497 ;
CP 47497

In Other Databases

PubChem 15942731
Wikipedia CP 47,497
ChEMBL CHEMBL163701
ChemSpider 10205286