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Ethyl (1R,1aR,6bS)-5-methyl-1a,6b-dihydro-1H-cyclopropa[b]benzofuran-1-carboxylate
SpectraBase Compound ID 4OEuiZZPHTU
InChI InChI=1S/C13H14O3/c1-3-15-13(14)11-10-8-6-7(2)4-5-9(8)16-12(10)11/h4-6,10-12H,3H2,1-2H3/t10-,11-,12-/m1/s1
InChIKey WYURHVUPWMVBQI-IJLUTSLNSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3D3KYWtz0f7
Name Ethyl (1R,1aR,6bS)-5-methyl-1a,6b-dihydro-1H-cyclopropa[b]benzofuran-1-carboxylate
Appearance clear oil
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Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-3-15-13(14)11-10-8-6-7(2)4-5-9(8)16-12(10)11/h4-6,10-12H,3H2,1-2H3/t10-,11-,12-/m1/s1
InChIKey WYURHVUPWMVBQI-IJLUTSLNSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.201903455
Molecular Weight 218.252 g/mol
SMILES c1(cc2c(O[C@@]3([C@@]2([H])[C@]3(C(=O)OCC)[H])[H])cc1)C
SPLASH splash10-0002-0910000000-24027131c417d8c7d87a
Sample Comments >99.9% de, >99.9% ee
Source of Spectrum ACI-58-SM36-5a
Wiley ID 1875355