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N-ACETYL-3-HEXANOYLTETRAMIC-ACID

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N-ACETYL-3-HEXANOYLTETRAMIC-ACID
SpectraBase Compound ID 66A8kabIbmU
InChI InChI=1S/C12H17NO4/c1-3-4-5-6-9(15)11-10(16)7-13(8(2)14)12(11)17/h17H,3-7H2,1-2H3
InChIKey ZBRFBGPGHCWMJS-UHFFFAOYSA-N
Mol Weight 239.27 g/mol
Molecular Formula C12H17NO4
Exact Mass 239.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6uiRQaca1XM
Name N-ACETYL-3-HEXANOYLTETRAMIC-ACID
Compound Number 6-CD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17NO4
InChI InChI=1S/C12H17NO4/c1-3-4-5-6-9(15)11-10(16)7-13(8(2)14)12(11)17/h17H,3-7H2,1-2H3
InChIKey ZBRFBGPGHCWMJS-UHFFFAOYSA-N
Literature Reference Author M.PETROLIAGI,O.IGGLESSI-MARKOPOULOU
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3543(1997)
Literature Reference DOI 10.1039/a702649h
Molecular Weight 239.271 g/mol
Solvent CDCl3
Source File Reference UWRU8087