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(2'-S)-2-(PROPAN-2'-OL)-5-HYDROXY-BENZOPYRAN-4-ONE
SpectraBase Compound ID 75887OTDh7R
InChI InChI=1S/C12H12O4/c1-7(13)5-8-6-10(15)12-9(14)3-2-4-11(12)16-8/h2-4,6-7,13-14H,5H2,1H3/t7-/m0/s1
InChIKey BEBIIRLVYJMQOS-ZETCQYMHSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EPESOO1a32w
Name (2'-S)-2-(PROPAN-2'-OL)-5-HYDROXY-BENZOPYRAN-4-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-7(13)5-8-6-10(15)12-9(14)3-2-4-11(12)16-8/h2-4,6-7,13-14H,5H2,1H3/t7-/m0/s1
InChIKey BEBIIRLVYJMQOS-ZETCQYMHSA-N
Literature Reference Author H.L.TELES,G.H.SILVA,I.CASTRO-GAMBAO,V.D.S.BOLZANI,J.O.PEREIR A,C.M.COSTA-NETO,R.H
Literature Reference Citation PHYTOCHEM.,66,2363(2005)
Literature Reference DOI 10.1016/j.phytochem.2005.04.043
Molecular Weight 220.225 g/mol
Solvent DMSO-D6
Source File Reference UWMZ19708