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LBIXXTNDQCWINR-UHFFFAOYSA-N
SpectraBase Compound ID IZ05pa0HJLW
InChI InChI=1S/C12H12O3/c1-7(13)8-4-5-9-10(6-8)14-12(3)11(9,2)15-12/h4-6H,1-3H3
InChIKey LBIXXTNDQCWINR-UHFFFAOYSA-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 2K9NC8vOvkc
Name LBIXXTNDQCWINR-UHFFFAOYSA-N
CAS Registry Number 131588-88-0
Compound Number 2I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12O3
InChI InChI=1S/C12H12O3/c1-7(13)8-4-5-9-10(6-8)14-12(3)11(9,2)15-12/h4-6H,1-3H3
InChIKey LBIXXTNDQCWINR-UHFFFAOYSA-N
Literature Reference Author W.ADAM,J.BIALAS,L.HADJIARAPOGLOU,M.SAUTER
Literature Reference Citation CHEM.BER.,125,231(1992)
Literature Reference DOI 10.1002/cber.19921250136
Molecular Weight 204.225 g/mol
Solvent ACETONE-D6
Source File Reference UWCS8643