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1-ETHOXYCARBONYL-4-METHYL-6-PHENYLETHYNYL-3-OXABICYCLO[3.1.0]HEXAN-2-ONE (ISOMER MIXTURE)
SpectraBase Compound ID IoS8YjSS8if
InChI InChI=1S/C17H16O4/c1-3-20-15(18)17-13(14(17)11(2)21-16(17)19)10-9-12-7-5-4-6-8-12/h4-8,11,13-14H,3H2,1-2H3/t11-,13?,14-,17+/m0/s1
InChIKey BPQIYOOFAQCEGF-XNCITRBZSA-N
Mol Weight 284.31 g/mol
Molecular Formula C17H16O4
Exact Mass 284.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JSJzywZbbzd
Name 1-ETHOXYCARBONYL-4-METHYL-6-PHENYLETHYNYL-3-OXABICYCLO[3.1.0]HEXAN-2-ONE (ISOMER MIXTURE)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H16O4
InChI InChI=1S/C17H16O4/c1-3-20-15(18)17-13(14(17)11(2)21-16(17)19)10-9-12-7-5-4-6-8-12/h4-8,11,13-14H,3H2,1-2H3/t11-,13?,14-,17+/m0/s1
InChIKey BPQIYOOFAQCEGF-XNCITRBZSA-N
Instrument Name Bruker AM-300
Literature Reference A.N.KASATKIN, A.N.KULAK, R.KH.BIKTIMIROV, G.A.TOLSTIKOV, O.V.SHITIKOVA,V.R.SULTANMURATOVA (1992) Izv.Akad.Nauk SSSR(Russ. Lang.): N4, 946-954.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d