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Cetirizine dihydrochloride
SpectraBase Compound ID 3RqqfSQgkMA
InChI InChI=1S/C21H25ClN2O3.2ClH/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26;;/h1-9,21H,10-16H2,(H,25,26);2*1H
InChIKey PGLIUCLTXOYQMV-UHFFFAOYSA-N
Mol Weight 461.82 g/mol
Molecular Formula C21H27Cl3N2O3
Exact Mass 460.108726 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 3BDpimDgeIe
Name Cetirizine dihydrochloride
Source of Sample Sigma-Aldrich Inc.
Catalog Number C3618
Lot Number 100M4726V
CAS Registry Number 83881-52-1
Compound Type Pure
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25ClN2O3
InChI InChI=1S/C21H25ClN2O3.2ClH/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26;;/h1-9,21H,10-16H2,(H,25,26);2*1H
InChIKey PGLIUCLTXOYQMV-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 Degree backscatter
Raman Laser Source Nd: YAG
Raman Laser Wavelength 1064
Sadtler IR Number DW2315
Source of Spectrum Forensic Spectral Research
Synonyms Zyrtec; [2-[4-[(4-Chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]acetic acid dihydrochloride
Technique FT-Raman