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Ziprasidone
SpectraBase Compound ID J0DibV8OmGG
InChI InChI=1S/C21H21ClN4OS/c22-17-13-18-15(12-20(27)23-18)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)28-24-21/h1-4,11,13H,5-10,12H2,(H,23,27)
InChIKey MVWVFYHBGMAFLY-UHFFFAOYSA-N
Mol Weight 412.94 g/mol
Molecular Formula C21H21ClN4OS
Exact Mass 412.11246 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID EaBY4Z0wS3n
Name Ziprasidone
Source of Sample Lipomed AG
Catalog Number Free base of ZPR-1234-HCL
Lot Number Free base of 1234.1B0.1
Accessory DurasamplIR II
CAS Registry Number 146939-27-7
Classification antipsychotic
Compound Type Pure
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21ClN4OS
InChI InChI=1S/C21H21ClN4OS/c22-17-13-18-15(12-20(27)23-18)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)28-24-21/h1-4,11,13H,5-10,12H2,(H,23,27)
InChIKey MVWVFYHBGMAFLY-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Sample Preparation Procedure The HCl salt was dissolved in 0.5 ml water in a test tube, and 1 drop of 30% NaOH solution was added, causing the clear solution to turn cloudy white. 1 ml dichloromethane was added to the test tube, which was shaken thoroughly using a vortex mixer. The test tube was spun in a centrifuge to separate the organic and aqueous layers. The bottom organic layer was retrieved with a pipette and placed in another clean test tube. The solvent was evaporated from the tube using a flow of nitrogen gas which resulted in the formation of a solid.
Source of Spectrum Forensic Spectral Research
Synonyms 5-[2-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]ethyl]-6-chloro-1,3-dihydro-2H-indol-2-one
Technique ATR-Neat (DuraSamplIR II)