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Ciclotizolam
SpectraBase Compound ID 46GIMhMkD0o
InChI InChI=1S/C20H18BrClN4S/c21-16-10-14-18(13-8-4-5-9-15(13)22)23-11-17-24-25-19(26(17)20(14)27-16)12-6-2-1-3-7-12/h4-5,8-10,12H,1-3,6-7,11H2
InChIKey ZOSHXIXUCKESEG-UHFFFAOYSA-N
Mol Weight 461.81 g/mol
Molecular Formula C20H18BrClN4S
Exact Mass 460.012408 g/mol
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Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 7eQBJ74BA69
Name Ciclotizolam
Source of Sample Cayman Chemical Company
Catalog Number 37999
Lot Number 0668803-4
Accessory DurasamplIR II
CAS Registry Number 58765-21-2
Copyright Copyright © 2019-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.012408470 u
Formula C20H18BrClN4S
InChI InChI=1S/C20H18BrClN4S/c21-16-10-14-18(13-8-4-5-9-15(13)22)23-11-17-24-25-19(26(17)20(14)27-16)12-6-2-1-3-7-12/h4-5,8-10,12H,1-3,6-7,11H2
InChIKey ZOSHXIXUCKESEG-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 461.809 g/mol
Purity ≥98%
Resolution 4
SMILES C=12N(C3=C(C(=NC2)C=2C(=CC=CC2)Cl)C=C(S3)Br)C(=NN1)C1CCCCC1
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms 2-bromo-4-(2-chlorophenyl)-9-cyclohexyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine WE-973
Technique ATR-Neat
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