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3-Methyl-3-hydroxy-7-syn-methoxycarbonyl-bicyclo(2.2.2)oct-5-en-2-one-8-carboxylic acid, lactone
SpectraBase Compound ID BzJQpYdcQvC
InChI InChI=1S/C12H12O5/c1-12-6-4-3-5(9(12)13)7(10(14)16-2)8(6)11(15)17-12/h3-8H,1-2H3/t5-,6+,7-,8+,12-/m1/s1
InChIKey ZSTGJZNUXMAUBH-LNTKHEMPSA-N
Mol Weight 236.22 g/mol
Molecular Formula C12H12O5
Exact Mass 236.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Av9VrmBOwvc
Name 3-Methyl-3-hydroxy-7-syn-methoxycarbonyl-bicyclo(2.2.2)oct-5-en-2-one-8-carboxylic acid, lactone
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Formula C12H12O5
InChI InChI=1S/C12H12O5/c1-12-6-4-3-5(9(12)13)7(10(14)16-2)8(6)11(15)17-12/h3-8H,1-2H3/t5-,6+,7-,8+,12-/m1/s1
InChIKey ZSTGJZNUXMAUBH-LNTKHEMPSA-N
Instrument Name Varian CFT-20
Literature Reference G.E. Langford, H. Auksi, J.A. Gosbee, Tetrahedron 37, 1091 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3