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3-(2-HYDROXY-4-ISOPROPYL-6-OXOCYCLOHEX-1-ENYL)-ISOBENZOFURAN-1(3H)-ONE
SpectraBase Compound ID FjhieegEZb9
InChI InChI=1S/C17H18O4/c1-9(2)10-7-13(18)15(14(19)8-10)16-11-5-3-4-6-12(11)17(20)21-16/h3-6,9-10,16,18H,7-8H2,1-2H3
InChIKey AAFBKWAFOMHXNA-UHFFFAOYSA-N
Mol Weight 286.33 g/mol
Molecular Formula C17H18O4
Exact Mass 286.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1L9DKmNePDJ
Name 3-(2-HYDROXY-4-ISOPROPYL-6-OXOCYCLOHEX-1-ENYL)-ISOBENZOFURAN-1(3H)-ONE
Compound Number 13
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18O4
InChI InChI=1S/C17H18O4/c1-9(2)10-7-13(18)15(14(19)8-10)16-11-5-3-4-6-12(11)17(20)21-16/h3-6,9-10,16,18H,7-8H2,1-2H3
InChIKey AAFBKWAFOMHXNA-UHFFFAOYSA-N
Literature Reference Author R.R.TEIXEIRA,G.C.BRESSAN,W.L.PEREIRA,J.G.FERREIRA,F.M.D.OLIV EIRA,D.C.THOMAZ
Literature Reference Citation MOLECULES,18,1881(2013)
Literature Reference DOI 10.3390/molecules18021881
Molecular Weight 286.328 g/mol
Solvent CD3OD
Source File Reference UWBT8779