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F553ezdM0Rz
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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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Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID F553ezdM0Rz
Name Ciclotizolam
Source of Sample Cayman Chemical Company
Catalog Number 37999
Lot Number 0668803-4
Apodization Filter Function Happ-Genzel
CAS Registry Number 58765-21-2
Copyright Copyright © 2015-2025 John Wiley & Sons, Inc. All Rights Reserved.
Detector NICOLET 000-877502 InGaAs
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 Thermo Nicolet 960 ESP
Laser Power 1.3 W
Raman Corrections Referenced to internal white light source: 180 Degree backscatter
Raman Laser Frequency 9393.64 cm⁻¹
Raman Laser Source Nd:YAG
Raman Technique neat on post
SMILES C=1(Br)SC2=C(C1)C(=NCC1=NN=C(N21)C1CCCCC1)C=1C=CC=CC1Cl
Scans Performed 1344
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
Technique FT-Raman
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