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5-Methoxy-4-methyl-6-[(E)-3-methyl-6-oxidanyl-hex-2-enyl]-7-oxidanyl-3H-2-benzofuran-1-one
SpectraBase Compound ID 9WyoHZlIUY5
InChI InChI=1S/C17H22O5/c1-10(5-4-8-18)6-7-12-15(19)14-13(9-22-17(14)20)11(2)16(12)21-3/h6,18-19H,4-5,7-9H2,1-3H3/b10-6+
InChIKey UVPJMDATXMSXJO-UXBLZVDNSA-N
Mol Weight 306.36 g/mol
Molecular Formula C17H22O5
Exact Mass 306.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IayBV4i6yLQ
Name (E)-6-(1,3-Dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-4-hexenol
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Formula C17H22O5
InChI InChI=1S/C17H22O5/c1-10(5-4-8-18)6-7-12-15(19)14-13(9-22-17(14)20)11(2)16(12)21-3/h6,18-19H,4-5,7-9H2,1-3H3/b10-6+
InChIKey UVPJMDATXMSXJO-UXBLZVDNSA-N
Instrument Name Bruker WH-270
Literature Reference R.L. Danheiser, S.K. Gee, J.J.Perez, J. Am. Chem. Soc. 108, 806 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3