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RUAIRYFQEMQMHV-GZAHSSCXSA-N
SpectraBase Compound ID CuUmIsjtfV1
InChI InChI=1S/C12H12O3/c1-12-3-2-5(4-12)6-7(12)9(14)11-10(15-11)8(6)13/h2-3,5-7,10-11H,4H2,1H3/t5-,6?,7?,10-,11+,12-/m1/s1
InChIKey RUAIRYFQEMQMHV-GZAHSSCXSA-N
Mol Weight 204.22 g/mol
Molecular Formula C12H12O3
Exact Mass 204.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BlMegEHfMVS
Name RUAIRYFQEMQMHV-GZAHSSCXSA-N
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12O3
InChI InChI=1S/C12H12O3/c1-12-3-2-5(4-12)6-7(12)9(14)11-10(15-11)8(6)13/h2-3,5-7,10-11H,4H2,1H3/t5-,6?,7?,10-,11+,12-/m1/s1
InChIKey RUAIRYFQEMQMHV-GZAHSSCXSA-N
Literature Reference Author W.B.SMITH,A.P.MARCHAND,S.C.SURI,P.-W.JIN
Literature Reference Citation J.ORG.CHEM.,51,3052(1986)
Literature Reference DOI 10.1021/jo00365a036
Molecular Weight 204.225 g/mol
Solvent CDCl3
Source File Reference UWGB475