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ENT-(3AR,6R,7AS)-3A,6,7,7A-TETRAHYDRO-6-METHYL-3H-ISOBENZOFURAN-1-ONE
SpectraBase Compound ID L8JU9ngKL3x
InChI InChI=1S/C9H12O2/c1-6-2-3-7-5-11-9(10)8(7)4-6/h2-3,6-8H,4-5H2,1H3/t6-,7-,8-/m0/s1
InChIKey QLUZGXTYFZJNDE-FXQIFTODSA-N
Mol Weight 152.19 g/mol
Molecular Formula C9H12O2
Exact Mass 152.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J06XYnC6Qnn
Name ENT-(3AR,6R,7AS)-3A,6,7,7A-TETRAHYDRO-6-METHYL-3H-ISOBENZOFURAN-1-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12O2
InChI InChI=1S/C9H12O2/c1-6-2-3-7-5-11-9(10)8(7)4-6/h2-3,6-8H,4-5H2,1H3/t6-,7-,8-/m0/s1
InChIKey QLUZGXTYFZJNDE-FXQIFTODSA-N
Literature Reference Author D.E.WARD,M.S.SOUWEHA
Literature Reference Citation ORG.LETTERS,7,3533(2005)
Literature Reference DOI 10.1021/ol051262e
Molecular Weight 152.193 g/mol
Sample ID 57599
Solvent CDCl3