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2-(2-METHYLPROPANOYL)-1,3,5-BENZENETRIOL
SpectraBase Compound ID JTmdQNY8Mzg
InChI InChI=1S/C10H12O4/c1-5(2)10(14)9-7(12)3-6(11)4-8(9)13/h3-5,11-13H,1-2H3
InChIKey BNEBXEZRBLYBCZ-UHFFFAOYSA-N
Mol Weight 196.2 g/mol
Molecular Formula C10H12O4
Exact Mass 196.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ADphsqZBxps
Name 2-(2-METHYLPROPANOYL)-1,3,5-BENZENETRIOL
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12O4
InChI InChI=1S/C10H12O4/c1-5(2)10(14)9-7(12)3-6(11)4-8(9)13/h3-5,11-13H,1-2H3
InChIKey BNEBXEZRBLYBCZ-UHFFFAOYSA-N
Literature Reference Author G.BOHR,C.GERHAEUSSER,J.KNAUFT,J.ZAPP,H.BECKER
Literature Reference Citation J.NAT.PROD.,68,1545(2005)
Literature Reference DOI 10.1021/np050164z
Molecular Weight 196.203 g/mol
Solvent CD3OD
Source File Reference UWMZ13020