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(E)-3-(BENZOYLOXYMETHYLENE)-TRANS-HEXAHYDRO-2(3H)-BENZOFURANONE
SpectraBase Compound ID JAJouW0BrMR
InChI InChI=1S/C16H16O4/c17-15(11-6-2-1-3-7-11)19-10-13-12-8-4-5-9-14(12)20-16(13)18/h1-3,6-7,10,12,14H,4-5,8-9H2/b13-10+/t12-,14+/m1/s1
InChIKey MTQQAACFJWKDAK-JBUYOTSVSA-N
Mol Weight 272.3 g/mol
Molecular Formula C16H16O4
Exact Mass 272.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BjWvBbV0XMV
Name (E)-3-(BENZOYLOXYMETHYLENE)-TRANS-HEXAHYDRO-2(3H)-BENZOFURANONE
Comments þÒ
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Formula C16H16O4
InChI InChI=1S/C16H16O4/c17-15(11-6-2-1-3-7-11)19-10-13-12-8-4-5-9-14(12)20-16(13)18/h1-3,6-7,10,12,14H,4-5,8-9H2/b13-10+/t12-,14+/m1/s1
InChIKey MTQQAACFJWKDAK-JBUYOTSVSA-N
Instrument Name Tesla BS567A
Literature Reference C.MAZAL, J.JONAS (1987) Coll.Czech.Chem.Comm.: v.52, N1, 199-206.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d