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Sertraline HCl

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

Sertraline HCl
SpectraBase Compound ID LXHmZqGAVWX
InChI InChI=1S/C17H17Cl2N.ClH/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11;/h2-6,8,10,12,17,20H,7,9H2,1H3;1H/t12-,17-;/m0./s1
InChIKey BLFQGGGGFNSJKA-XHXSRVRCSA-N
Mol Weight 342.7 g/mol
Molecular Formula C17H18Cl3N
Exact Mass 341.050483 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID HvHrt8icMe6
Name Sertraline HCl
Source of Sample Alltech Associates, Inc., Grace Davison Discovery Sciences
Catalog Number 01557
Lot Number 070695B
Accessory DurasamplIR II
CAS Registry Number 79559-97-0
Classification Selective serotonin uptake inhibitor
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18Cl3N
InChI InChI=1S/C17H17Cl2N.ClH/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11;/h2-6,8,10,12,17,20H,7,9H2,1H3;1H/t12-,17-;/m0./s1
InChIKey BLFQGGGGFNSJKA-XHXSRVRCSA-N
Instrument Name Bio-Rad FTS
Source of Spectrum Forensic Spectral Research
Synonyms ZOLOFT 1-Naphthalenamine, 4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-, hydrochloride, (1S-cis)-
Technique ATR-Neat (DuraSamplIR II)