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5,6,7,7a-Tetrahydro-7-hydroxy-5,7-dimethyl-benzofuran-2(4H)-one (A)
SpectraBase Compound ID KNPIdoH4Idj
InChI InChI=1S/C10H14O3/c1-6-3-7-4-8(11)13-9(7)10(2,12)5-6/h4,6,9,12H,3,5H2,1-2H3
InChIKey ZNZAHSNALHKAOF-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4SE6hj7It59
Name 5,6,7,7a-Tetrahydro-7-hydroxy-5,7-dimethyl-benzofuran-2(4H)-one (A)
CAS Registry Number 71055-39-5
Comments OH & LACTON-O: TRANS UNKNOWN CONFIG. AT C-5, OPPOSITE TO #3092
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-6-3-7-4-8(11)13-9(7)10(2,12)5-6/h4,6,9,12H,3,5H2,1-2H3
InChIKey ZNZAHSNALHKAOF-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference N. Bensel, J. Hoehn, H. Marschall, Chem. Ber. 112, 2256 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3