N-Desmethylvenlafaxine

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Systematic / IUPAC Name: 1-[1-(4-Methoxyphenyl)-2-(methylamino)ethyl]cyclohexanol

ID: Reference1092

Other Names: Rac N-desmethyl venlafaxine;
Cyclohexanol, 1-[1-(4-methoxyphenyl)-2-(methylamino)ethyl]-

Formula: C16H25NO2

Class: Therapeutics/Prescription Drugs

Spectral Data

N-Desmethylvenlafaxine 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 LTQ Orbitrap XL; Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 98
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/11/2015 1:48:21 PM
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Identificators

InChI InChI=1S/C16H25NO2/c1-17-12-15(16(18)10-4-3-5-11-16)13-6-8-14(19-2)9-7-13/h6-9,15,17-18H,3-5,10-12H2,1-2H3
InChI Key MKAFOJAJJMUXLW-UHFFFAOYSA-N
Canonical SMILES CNCC(C1=CC=C(C=C1)OC)C2(CCCCC2)O
CAS 149289305
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Other Names Rac N-desmethyl venlafaxine;
Cyclohexanol, 1-[1-(4-methoxyphenyl)-2-(methylamino)ethyl]-

In Other Databases

ChemSpider 2741972
ChEMBL CHEMBL1119
PubChem 3501942