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Metixene HCl Hydrate
SpectraBase Compound ID EPuWoTnZBFh
InChI InChI=1S/C20H23NS.Cl.O/c1-21-12-6-7-15(14-21)13-18-16-8-2-4-10-19(16)22-20-11-5-3-9-17(18)20;;/h2-5,8-11,15,18H,6-7,12-14H2,1H3;;
InChIKey PKFBTUMDRUAAMG-UHFFFAOYSA-N
Mol Weight 360.92 g/mol
Molecular Formula C20H23ClNOS
Exact Mass 360.118888 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 4GtolvcziD9
Name Metixene HCl Hydrate
Source of Sample Cayman Chemical Company
Catalog Number 39825
Lot Number 0692848-1
Apodization Filter Function Happ-Genzel
CAS Registry Number 7081-40-5
Copyright Copyright © 2015-2025 John Wiley & Sons, Inc. All Rights Reserved.
Detector NICOLET 000-877502 InGaAs
Exact Mass 360.118888238 u
Formula C20H23ClNOS
InChI InChI=1S/C20H23NS.Cl.O/c1-21-12-6-7-15(14-21)13-18-16-8-2-4-10-19(16)22-20-11-5-3-9-17(18)20;;/h2-5,8-11,15,18H,6-7,12-14H2,1H3;;
InChIKey PKFBTUMDRUAAMG-UHFFFAOYSA-N
Instrument Name Thermo Nicolet 960 ESP
Laser Power 1.501 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 [Cl].[O].C=12SC=3C=CC=CC3C(C1C=CC=C2)CC1CCCN(C)C1
Scans Performed 1280
Source of Spectrum Forensic Spectral Research
Synonyms 1-methyl-3-(9H-thioxanthen-9-ylmethyl)-piperidine, monohydrochloride, monohydrate
Technique FT-Raman