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(R)-3-HYDROXY-1-[(R)-4-HYDROXY-1,3-DIHYDROISOBENZOFURAN-1-1-YL]-BUTAN-2-ONE
SpectraBase Compound ID HrNHBA1TF69
InChI InChI=1S/C12H14O4/c1-7(13)11(15)5-12-8-3-2-4-10(14)9(8)6-16-12/h2-4,7,12-14H,5-6H2,1H3/t7-,12-/m1/s1
InChIKey BBGDMJGYFNHPDK-JMCQJSRRSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5j9hH0PBz11
Name (R)-3-HYDROXY-1-[(R)-4-HYDROXY-1,3-DIHYDROISOBENZOFURAN-1-1-YL]-BUTAN-2-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-7(13)11(15)5-12-8-3-2-4-10(14)9(8)6-16-12/h2-4,7,12-14H,5-6H2,1H3/t7-,12-/m1/s1
InChIKey BBGDMJGYFNHPDK-JMCQJSRRSA-N
Literature Reference Author J.R.KESTING,L.OLSEN,D.STAERK,M.V.TEJESVI,K.R.KINI,H.S.PRAKAS H,J.W.JAROSZEWSKI
Literature Reference Citation J.NAT.PROD.,74,2206(2011)
Literature Reference DOI 10.1021/np2005665
Molecular Weight 222.241 g/mol
Sample ID 39428
Solvent CD3CN