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Diethyl (S)-2-allyl-2-(1-phenylallyl)malonate
SpectraBase Compound ID Bkl2ZQ4N0TB
InChI InChI=1S/C19H24O4/c1-5-14-19(17(20)22-7-3,18(21)23-8-4)16(6-2)15-12-10-9-11-13-15/h5-6,9-13,16H,1-2,7-8,14H2,3-4H3/t16-/m0/s1
InChIKey VIAAVPOUASDQTQ-INIZCTEOSA-N
Mol Weight 316.4 g/mol
Molecular Formula C19H24O4
Exact Mass 316.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3elv8PsvY12
Name Diethyl (S)-2-allyl-2-(1-phenylallyl)malonate
Comments Computed using HOSE algorithm
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Exact Mass 316.167459249 u
Formula C19H24O4
InChI InChI=1S/C19H24O4/c1-5-14-19(17(20)22-7-3,18(21)23-8-4)16(6-2)15-12-10-9-11-13-15/h5-6,9-13,16H,1-2,7-8,14H2,3-4H3/t16-/m0/s1
InChIKey VIAAVPOUASDQTQ-INIZCTEOSA-N
Molecular Weight 316.397 g/mol
SMILES C(C(C(=O)OCC)([C@@](C=C)(C=1C=CC=CC1)[H])CC=C)(=O)OCC