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(+/-)-2-HYDROXYMETHYL-1-(2-HYDROXY-4-METHOXYPHENYL)-BUTAN-1-ONE
SpectraBase Compound ID JsEj25nzmp9
InChI InChI=1S/C12H16O4/c1-3-8(7-13)12(15)10-5-4-9(16-2)6-11(10)14/h4-6,8,13-14H,3,7H2,1-2H3
InChIKey APEVQKFOLNUACZ-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3QCw0GiSM2F
Name (+/-)-2-HYDROXYMETHYL-1-(2-HYDROXY-4-METHOXYPHENYL)-BUTAN-1-ONE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-3-8(7-13)12(15)10-5-4-9(16-2)6-11(10)14/h4-6,8,13-14H,3,7H2,1-2H3
InChIKey APEVQKFOLNUACZ-UHFFFAOYSA-N
Literature Reference Author R.KUMAR,A.AZIM,V.KUMAR,S.K.SHARMA,A.K.PRASAD,O.W.HOWARTH,C.E .OLS
Literature Reference Citation BIOORG.MED.CHEM.,9,2643(2001)
Literature Reference DOI 10.1016/S0968-0896(01)00184-5
Molecular Weight 224.257 g/mol
Solvent CDCl3
Source File Reference UWMS22207