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(5R*,1'R*)-5-(1'-HYDROXYBUTYL)-3-METHYLIDENETETRAHYDRO-2-FURANONE
SpectraBase Compound ID k6PDdFFXsD
InChI InChI=1S/C9H14O3/c1-3-4-7(10)8-5-6(2)9(11)12-8/h7-8,10H,2-5H2,1H3/t7-,8-/m1/s1
InChIKey DIFVTUZWBSKPOE-HTQZYQBOSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AA2t9kHgoom
Name (5R*,1'R*)-5-(1'-HYDROXYBUTYL)-3-METHYLIDENETETRAHYDRO-2-FURANONE
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-3-4-7(10)8-5-6(2)9(11)12-8/h7-8,10H,2-5H2,1H3/t7-,8-/m1/s1
InChIKey DIFVTUZWBSKPOE-HTQZYQBOSA-N
Literature Reference Author T.JANECKI,E.BLASZCZYK,K.STUDZIAN,M.ROZALSKI,U.KRAJEWSKA,A.JA NECKA
Literature Reference Citation J.MED.CHEM.,45,1142(2002)
Literature Reference DOI 10.1021/jm011019v
Molecular Weight 170.208 g/mol
Sample ID 52857
Solvent CDCl3