John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FPdwQR4zPkb SpectraBase Spectrum ID=105hh4V6qDy

(accessed ).
MKJDXUMZAGEQMK-UHFFFAOYSA-N
SpectraBase Compound ID FPdwQR4zPkb
InChI InChI=1S/C13H16O4/c1-10(14)12-4-6-13(7-5-12)17-9-3-8-16-11(2)15/h4-7H,3,8-9H2,1-2H3
InChIKey MKJDXUMZAGEQMK-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 105hh4V6qDy
Name MKJDXUMZAGEQMK-UHFFFAOYSA-N
Compound Number 2(3)
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-10(14)12-4-6-13(7-5-12)17-9-3-8-16-11(2)15/h4-7H,3,8-9H2,1-2H3
InChIKey MKJDXUMZAGEQMK-UHFFFAOYSA-N
Literature Reference Author J.L.BESOMBES,B.CHEMINAT,G.MOUSSET,C.MOUSTY
Literature Reference Citation BULL.SOC.CHIM.FR.,129,513(1992)
Molecular Weight 236.268 g/mol
Solvent CDCl3
Source File Reference UWSK2231
SpectraBase Batch ID CV3jzf8kFuE