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Cetirizine
SpectraBase Compound ID 2H3JaMCykFh
InChI InChI=1S/C21H25ClN2O3/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)
InChIKey ZKLPARSLTMPFCP-UHFFFAOYSA-N
Mol Weight 388.9 g/mol
Molecular Formula C21H25ClN2O3
Exact Mass 388.15537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J6SwDUmXtjR
Name 2-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)ethoxy)acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25ClN2O3
InChI InChI=1S/C21H25ClN2O3/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)
InChIKey ZKLPARSLTMPFCP-UHFFFAOYSA-N
Molecular Weight 388.895 g/mol
SMILES OC(COCCN1CCN(C(c2ccccc2)c2ccc(cc2)Cl)CC1)=O
SPLASH splash10-014i-0942000000-0f6f92a1ca4afd849e5c
Source of Spectrum Ma Dehua, et al. Science of the Total Environment, V.595, 2017, P.702-710
Wiley ID 1816387