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(1R,2R)-(+-)-Methyl 2-(2-benzoyl-3-methylcyclopropyl)acetate
SpectraBase Compound ID FxuDHqHUjhr
InChI InChI=1S/C14H16O3/c1-9-11(8-12(15)17-2)13(9)14(16)10-6-4-3-5-7-10/h3-7,9,11,13H,8H2,1-2H3/t9?,11-,13-/m1/s1
InChIKey MRKLFYDBCJFCRA-HRBVQNPCSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7aUK4hK2Bmu
Name (1R,2R)-(+-)-Methyl 2-(2-benzoyl-3-methylcyclopropyl)acetate
Alternate Name(s) Methyl[(1R,2R)-2-benzoyl-3-methylcyclopropyl]acetate trans-(+-)-Methyl 2-(2-benzoyl-3-methylcyclopropyl)acetate
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Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-9-11(8-12(15)17-2)13(9)14(16)10-6-4-3-5-7-10/h3-7,9,11,13H,8H2,1-2H3/t9?,11-,13-/m1/s1
InChIKey MRKLFYDBCJFCRA-HRBVQNPCSA-N
Molecular Weight 232.279 g/mol
SMILES [C@]1([C@](CC(=O)OC)(C1C)[H])(C(=O)c1ccccc1)[H]
SPLASH splash10-0a4i-0910000000-159198f0c3275a7d511f
Source of Spectrum J-65-5544-7
Wiley ID 1533082