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Zotepine
SpectraBase Compound ID 5MGBZjaNWO9
InChI InChI=1S/C18H18ClNOS/c1-20(2)9-10-21-16-11-13-5-3-4-6-17(13)22-18-8-7-14(19)12-15(16)18/h3-8,11-12H,9-10H2,1-2H3
InChIKey HDOZVRUNCMBHFH-UHFFFAOYSA-N
Mol Weight 331.86 g/mol
Molecular Formula C18H18ClNOS
Exact Mass 331.079763 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID ulilp5jiDq
Name Zotepine
Source of Sample Sigma-Aldrich Company LLC
Catalog Number Z0877
Lot Number 050M4717
Apodization Function Triangular
CAS Registry Number 26615-21-4
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18ClNOS
InChI InChI=1S/C18H18ClNOS/c1-20(2)9-10-21-16-11-13-5-3-4-6-17(13)22-18-8-7-14(19)12-15(16)18/h3-8,11-12H,9-10H2,1-2H3
InChIKey HDOZVRUNCMBHFH-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 331.861 g/mol
SMILES c1c2\C=C/(c3c(ccc(Cl)c3)Sc2ccc1)OCCN(C)C
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Technique KBr0