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3-Acetyl-6-hydroxy-2,7-dimethyl-1-(4-methylphenyl)-chinolinium-perchlorate
SpectraBase Compound ID IsPpjm9X5sT
InChI InChI=1S/C20H19NO2.ClHO4/c1-12-5-7-17(8-6-12)21-14(3)18(15(4)22)10-16-11-20(23)13(2)9-19(16)21;2-1(3,4)5/h5-11H,1-4H3;(H,2,3,4,5)
InChIKey XWZGASPGJWUWIR-UHFFFAOYSA-N
Mol Weight 405.83 g/mol
Molecular Formula C20H20ClNO6
Exact Mass 405.097915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HjdmifbeIM
Name 3-Acetyl-6-hydroxy-2,7-dimethyl-1-(4-methylphenyl)-chinolinium-perchlorate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20ClNO6
InChI InChI=1S/C20H19NO2.ClHO4/c1-12-5-7-17(8-6-12)21-14(3)18(15(4)22)10-16-11-20(23)13(2)9-19(16)21;2-1(3,4)5/h5-11H,1-4H3;(H,2,3,4,5)
InChIKey XWZGASPGJWUWIR-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(200001)342_1_17
Molecular Weight 405.834 g/mol
SMILES [Cl](=O)(=O)(=O)[O-].Oc1cc2c([n+](-c3ccc(cc3)C)c(C)c(C(C)=O)c2)cc1C
SPLASH splash10-0006-9000000000-d7836e7fe73b4eda62ad
Source of Spectrum JF-342-23-18
Synonyms 3-Acetyl-6-hydroxy-2,7-dimethyl-1-(p-tolyl)quinolin-1-ium perchlorate
Wiley ID 1766803