W-18

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Systematic / IUPAC Name: 4-Chloro-N-{(2E)-1-[2-(4-nitrophenyl)ethyl]-2-piperidinylidene}benzenesulfonamide

ID: Reference4880

Other Names: 4-Chloro-N-[1-(4-nitrophenethyl)piperidin-2-ylidene]benzenesulfonamide ;
Benzenesulfonamide, 4-chloro-N-{(2E)-1-[2-(4-nitrophenyl)ethyl]-2-piperidinylidene}-

Formula: C19H20ClN3O4S

Class: Drugs of Abuse/Illegal Drugs Sports Doping Drugs

Spectral Data

W-18 mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Elite; Q Exactive Plus Orbitrap
No. of Spectral Trees 7
No. of Spectra 1681
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI; NSI
Analyzers IT; FT
Last Modification 1/25/2017 1:08:17 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C19H20ClN3O4S/c20-16-6-10-18(11-7-16)28(26,27)21-19-3-1-2-13-22(19)14-12-15-4-8-17(9-5-15)23(24)25/h4-11H,1-3,12-14H2/b21-19+
InChI Key BKRSVROQVRTSND-XUTLUUPISA-N
Canonical SMILES
CAS 93101021
Splash
Other Names 4-Chloro-N-[1-(4-nitrophenethyl)piperidin-2-ylidene]benzenesulfonamide ;
Benzenesulfonamide, 4-chloro-N-{(2E)-1-[2-(4-nitrophenyl)ethyl]-2-piperidinylidene}-

In Other Databases

Wikipedia W-18
ChemSpider 10544260
PubChem 13373555