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Niclosamide
SpectraBase Compound ID JuwWBuqjfoM
InChI InChI=1S/C13H8Cl2N2O4/c14-7-1-4-12(18)9(5-7)13(19)16-11-3-2-8(17(20)21)6-10(11)15/h1-6,18H,(H,16,19)
InChIKey RJMUSRYZPJIFPJ-UHFFFAOYSA-N
Mol Weight 327.12 g/mol
Molecular Formula C13H8Cl2N2O4
Exact Mass 325.986112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2od06TxUlqC
Name Niclosamide
CAS Registry Number 50-65-7
Classification Anthelmintic, molluscicide
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 325.986112142 u
Formula C13H8Cl2N2O4
InChI InChI=1S/C13H8Cl2N2O4/c14-7-1-4-12(18)9(5-7)13(19)16-11-3-2-8(17(20)21)6-10(11)15/h1-6,18H,(H,16,19)
InChIKey RJMUSRYZPJIFPJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 327.123 g/mol
Nominal Mass 326 u
Quality 964
Retention Index 2459
SMILES OC1=C(C(NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)=O)C=C(C=C1)Cl
SPLASH splash10-0a4i-2900000000-e230f7a38bb6662745ea
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Clonitralid 5-Chloro-N-(2-chloro-4-nitro-phenyl)-2-hydroxy-benzamide
Technique GC/MS
Wiley ID DD2024_003174