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(E)-2-ETHOXYCARBONYL-3-(2-METHYL-1-BUTEN-3-YL)-6-BROMO-4-HEXENOIC ACID,ETHYL ESTER (DIASTEREOMER MIXTURE)
SpectraBase Compound ID L4s2nzCo075
InChI InChI=1S/C16H25BrO4/c1-6-20-15(18)14(16(19)21-7-2)13(9-8-10-17)12(5)11(3)4/h8-9,12-14H,3,6-7,10H2,1-2,4-5H3/b9-8+
InChIKey TXZPBPJXEJWONN-CMDGGOBGSA-N
Mol Weight 361.28 g/mol
Molecular Formula C16H25BrO4
Exact Mass 360.093622 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jujt0b0SnNW
Name (E)-2-ETHOXYCARBONYL-3-(2-METHYL-1-BUTEN-3-YL)-6-BROMO-4-HEXENOIC ACID,ETHYL ESTER (DIASTEREOMER MIXTURE)
Comments =
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Formula C16H25BrO4
InChI InChI=1S/C16H25BrO4/c1-6-20-15(18)14(16(19)21-7-2)13(9-8-10-17)12(5)11(3)4/h8-9,12-14H,3,6-7,10H2,1-2,4-5H3/b9-8+
InChIKey TXZPBPJXEJWONN-CMDGGOBGSA-N
Instrument Name Jeol FX-90
Literature Reference A.N.KASATKIN, O.YU.TSYPYSHEV, T.YU.ROMANOVA, G.A.TOLSTIKOV (1991) Izv.Akad.NaukSSSR(Russ. Lang.): N3, 656-663.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d