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Tianeptine sodium salt

View entire compound with spectra: 2 FTIR, and 1 Raman

Tianeptine sodium salt
SpectraBase Compound ID Ed4EH1M6zMx
InChI InChI=1S/C21H25ClN2O4S.Na/c1-24-18-9-6-5-8-16(18)21(23-13-7-3-2-4-10-20(25)26)17-12-11-15(22)14-19(17)29(24,27)28;/h5-6,8-9,11-12,14,21,23H,2-4,7,10,13H2,1H3,(H,25,26);/q;+1/p-1
InChIKey ZLBSUOGMZDXYKE-UHFFFAOYSA-M
Mol Weight 458.93576928 g/mol
Molecular Formula C21H24ClN2NaO4S
Exact Mass 458.1043 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID Duy9y2Jn0wF
Name Tianeptine sodium salt
Source of Sample Cayman Chemical Company
Catalog Number 17561
Lot Number 0467324-1
Accessory DurasamplIR II
CAS Registry Number 30123-17-2
Classification atypical antidepressant with diverse actions, most notably on the glutamatergic system
Copyright Copyright © 2014-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24ClN2NaO4S
InChI InChI=1S/C21H25ClN2O4S.Na/c1-24-18-9-6-5-8-16(18)21(23-13-7-3-2-4-10-20(25)26)17-12-11-15(22)14-19(17)29(24,27)28;/h5-6,8-9,11-12,14,21,23H,2-4,7,10,13H2,1H3,(H,25,26);/q;+1/p-1
InChIKey ZLBSUOGMZDXYKE-UHFFFAOYSA-M
Instrument Name Bio-Rad FTS
Source of Spectrum Forensic Spectral Research
Synonyms 7-[(3-Chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]-heptanoic acid, monosodium salt
Technique ATR-Neat (DuraSamplIR II)