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IKGHIFGXPVLPFD-UHFFFAOYSA-N
SpectraBase Compound ID 6WTBfSIhLfe
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)
InChIKey IKGHIFGXPVLPFD-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1TlXnyZAnBe
Name IKGHIFGXPVLPFD-UHFFFAOYSA-N
Compound Number 2-H,H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15NO3
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)
InChIKey IKGHIFGXPVLPFD-UHFFFAOYSA-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 221.256 g/mol
Sample ID 50472
Solvent CDCl3