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ISMPTLAFXBBDLI-DJJLYXLKSA-N

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ISMPTLAFXBBDLI-DJJLYXLKSA-N
SpectraBase Compound ID L7Zw0rTZlgm
InChI InChI=1S/C13H14O3/c1-13(6-14)7-2-3-8(13)12-10(16)5-4-9(15)11(7)12/h2-5,7-8,11-12,14H,6H2,1H3/t7-,8+,11-,12+,13-
InChIKey ISMPTLAFXBBDLI-DJJLYXLKSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JJPVxyB2icY
Name ISMPTLAFXBBDLI-DJJLYXLKSA-N
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-13(6-14)7-2-3-8(13)12-10(16)5-4-9(15)11(7)12/h2-5,7-8,11-12,14H,6H2,1H3/t7-,8+,11-,12+,13-
InChIKey ISMPTLAFXBBDLI-DJJLYXLKSA-N
Literature Reference Author L.A.PAQUETTE,C.VANUCCI,R.D.ROGERS
Literature Reference Citation J.AM.CHEM.SOC.,111,5792(1989)
Literature Reference DOI 10.1021/ja00197a045
Molecular Weight 218.252 g/mol
Solvent CDCl3
Source File Reference UWED10379