CP 47,497-C6-Homolog

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

ID: Reference6302

Other Names: (C6)-CP-47497;
Phenol, 5-(1,1-dimethylhexyl)-2-[(1S,3R)-3-hydroxycyclohexyl]-;
cis-5-(1,1-Dimethylhexyl)-2-(3-hydroxycyclohexyl)-phenol

Formula: C20H32O2

Class: Drugs of Abuse/Illegal Drugs

Spectral Data

CP 47,497-C6-Homolog 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 2
No. of Spectra 234
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/20/2017 11:22:19 AM
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Identificators

InChI InChI=1S/C20H32O2/c1-4-5-6-12-20(2,3)16-10-11-18(19(22)14-16)15-8-7-9-17(21)13-15/h10-11,14-15,17,21-22H,4-9,12-13H2,1-3H3/t15-,17+/m0/s1
InChI Key KQUGQXNYBWYGAI-DOTOQJQBSA-N
Canonical SMILES CCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCC(C2)O)O
CAS 70435062
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Other Names (C6)-CP-47497;
Phenol, 5-(1,1-dimethylhexyl)-2-[(1S,3R)-3-hydroxycyclohexyl]-;
cis-5-(1,1-Dimethylhexyl)-2-(3-hydroxycyclohexyl)-phenol

In Other Databases

Wikipedia (C6)-CP 47,497
ChemSpider 29342068
PubChem 24041590