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1-METHYL-5,6-DIHYDRO-6-HYDROXYMETHYL-8-(4-CHLOROPHENYL)-(1H)-IMIDAZO-[3,2-D]-[1,4]-OXAZEPINIUM_METHANESULFONATE
SpectraBase Compound ID 92fJikXtJR1
InChI InChI=1S/C15H16ClN2O2.CH4O3S/c1-17-6-7-18-9-13(10-19)20-14(8-15(17)18)11-2-4-12(16)5-3-11;1-5(2,3)4/h2-8,13,19H,9-10H2,1H3;1H3,(H,2,3,4)/q+1;/p-1
InChIKey WHDMPPDPRFCDFK-UHFFFAOYSA-M
Mol Weight 386.85 g/mol
Molecular Formula C16H19ClN2O5S
Exact Mass 386.070321 g/mol
Parent InChIKey KXOMDJAASUTPTG-UHFFFAOYSA-M
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent D2O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Title Journal or Book Year
Synthesis,1H- and13C-NMR spectra, crystal structure and ring openings of 1-methyl-6,9-epoxy-9-aryl-5,6,9,10-tetrahydro-1H-imidazo [3,2-e] [2H-1,5] oxazocinium methanesulfonate Journal of Heterocyclic Chemistry 1997
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