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3-HYDROXY-4-HYDROXYIMINOMETHYL-5-HYDROXYMETHYL-2-METHYL-1-PHENACYLPYRIDINIUM-BROMIDE
SpectraBase Compound ID 29d6lyZMcBK
InChI InChI=1S/C16H16N2O4.BrH/c1-11-16(21)14(7-17-22)13(10-19)8-18(11)9-15(20)12-5-3-2-4-6-12;/h2-8,19,21H,9-10H2,1H3;1H
InChIKey CXXVFAFTIBGYPZ-UHFFFAOYSA-N
Mol Weight 381.23 g/mol
Molecular Formula C16H17BrN2O4
Exact Mass 380.03717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HGAhngYO4aK
Name 3-HYDROXY-4-HYDROXYIMINOMETHYL-5-HYDROXYMETHYL-2-METHYL-1-PHENACYLPYRIDINIUM-BROMIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H16BrN2O4
InChI InChI=1S/C16H16N2O4.BrH/c1-11-16(21)14(7-17-22)13(10-19)8-18(11)9-15(20)12-5-3-2-4-6-12;/h2-8,19,21H,9-10H2,1H3;1H
InChIKey CXXVFAFTIBGYPZ-UHFFFAOYSA-N
Literature Reference Author D.GASO-SOKAC,V.BUSIC,M.CETINA,M.JUKIC
Literature Reference Citation MOLECULES,19,7610(2014)
Literature Reference DOI 10.3390/molecules19067610
Molecular Weight 380.218 g/mol
Solvent DMSO-D6
Source File Reference UWIR14738