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Cetirizine TMS
SpectraBase Compound ID IvxXloKMOMY
InChI InChI=1S/C24H33ClN2O3Si/c1-31(2,3)30-23(28)19-29-18-17-26-13-15-27(16-14-26)24(20-7-5-4-6-8-20)21-9-11-22(25)12-10-21/h4-12,24H,13-19H2,1-3H3
InChIKey RIQVGCSRGRHJJH-UHFFFAOYSA-N
Mol Weight 461.1 g/mol
Molecular Formula C24H33ClN2O3Si
Exact Mass 460.194897 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DoU8sliVJQ0
Name Cetirizine TMS
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 460.194897163 u
Formula C24H33ClN2O3Si
InChI InChI=1S/C24H33ClN2O3Si/c1-31(2,3)30-23(28)19-29-18-17-26-13-15-27(16-14-26)24(20-7-5-4-6-8-20)21-9-11-22(25)12-10-21/h4-12,24H,13-19H2,1-3H3
InChIKey RIQVGCSRGRHJJH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 461.077 g/mol
Nominal Mass 460 u
Quality 990
Retention Index 3435
SMILES C(N1CCN(CC1)CCOCC(O[Si](C)(C)C)=O)(C1=CC=C(C=C1)Cl)C1=CC=CC=C1
SPLASH splash10-0udi-2390000000-a55ec6810b08824881aa
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Trimethylsilyl [2-[4-[(4-chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]acetate trimethylsilyl (2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)ethoxy)acetate
Technique GC/MS
Wiley ID DD2024_019769