Flupentixol

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Systematic / IUPAC Name: 2-(4-{(3E)-3-[2-(Trifluoromethyl)-9H-thioxanthen-9-ylidene]propyl}-1-piperazinyl)ethanol

ID: Reference2146

Other Names: β-Flupenthixol;
Flupenthixol

Formula: C23H25F3N2OS

Class: Therapeutics/Prescription Drugs

Spectral Data

Flupentixol 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 1
No. of Spectra 45
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/2/2015 10:27:56 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C23H25F3N2OS/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29/h1-2,4-8,16,29H,3,9-15H2/b18-5+
InChI Key NJMYODHXAKYRHW-BLLMUTORSA-N
Canonical SMILES C1CN(CCN1CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCO
CAS 2709560
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Other Names β-Flupenthixol;
Flupenthixol

In Other Databases

Wikipedia Flupentixol
ChEMBL CHEMBL42055
ChemSpider 4445171
ChemIDPlus 053772853
PubChem 5281878