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IKGHIFGXPVLPFD-BNEYPBHNSA-N
SpectraBase Compound ID IZ07aSf9PLI
InChI InChI=1S/C12H15NO3/c1-9(14)13-11(12(15)16-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3,(H,13,14)/i8D
InChIKey IKGHIFGXPVLPFD-BNEYPBHNSA-N
Mol Weight 222.26 g/mol
Molecular Formula C12H142HNO3
Exact Mass 222.11147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FguD0qkrEWl
Name IKGHIFGXPVLPFD-BNEYPBHNSA-N
Compound Number 2-H,D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H142HNO3
InChI InChI=1S/C12H15NO3/c1-9(14)13-11(12(15)16-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3,(H,13,14)/i8D
InChIKey IKGHIFGXPVLPFD-BNEYPBHNSA-N
Literature Reference Author M.KITAMURA,M.TSUKAMOTO,Y.BESSHO,M.YOSHIMURA,U.KOBS,M.WIDHALM ,R.MOYORI
Literature Reference Citation J.AM.CHEM.SOC.,124,6649(2002)
Literature Reference DOI 10.1021/ja010982n
Molecular Weight 222.262 g/mol
Sample ID 50473
Solvent CDCl3