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Methyl (2RS)-3-(2-iodophenyl)-2-[(1SR)-2-oxocyclohexyl]propanoate
SpectraBase Compound ID HqEqn3Do3Wk
InChI InChI=1S/C16H19IO3/c1-20-15(18)10-9-11-5-4-7-13(16(11)19)12-6-2-3-8-14(12)17/h2-3,6,8,11,13H,4-5,7,9-10H2,1H3
InChIKey ZBJSMEPMGJDCQB-UHFFFAOYSA-N
Mol Weight 386.23 g/mol
Molecular Formula C16H19IO3
Exact Mass 386.037889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LbhDPVe2Wsq
Name METHYL-(2RS)-3-(2-IODOPHENYL)-2-[(1RS)-2-OXOCYCLOHEXYL)]-PROPANOATE
Compound Number SP8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H19IO3
InChI InChI=1S/C16H19IO3/c1-20-15(18)10-9-11-5-4-7-13(16(11)19)12-6-2-3-8-14(12)17/h2-3,6,8,11,13H,4-5,7,9-10H2,1H3
InChIKey ZBJSMEPMGJDCQB-UHFFFAOYSA-N
Literature Reference Author J.SAADI,I.BRUEDGAM,H.U.REISSIG
Literature Reference Citation BEIL.J.ORG.CHEM.,6,1229(2010)
Literature Reference DOI 10.3762/bjoc.6.141
Molecular Weight 386.230 g/mol
Solvent CDCl3
Source File Reference UWBT10299