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(2E)-4-OXOHEXADEC-2-ENOIC-ACID
SpectraBase Compound ID 7CN7jtWDifi
InChI InChI=1S/C16H28O3/c1-2-3-4-5-6-7-8-9-10-11-12-15(17)13-14-16(18)19/h13-14H,2-12H2,1H3,(H,18,19)/b14-13+
InChIKey SWMQZEIJDYTILH-BUHFOSPRSA-N
Mol Weight 268.4 g/mol
Molecular Formula C16H28O3
Exact Mass 268.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EvdVI9l5ztz
Name (2E)-4-OXOHEXADEC-2-ENOIC-ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28O3
InChI InChI=1S/C16H28O3/c1-2-3-4-5-6-7-8-9-10-11-12-15(17)13-14-16(18)19/h13-14H,2-12H2,1H3,(H,18,19)/b14-13+
InChIKey SWMQZEIJDYTILH-BUHFOSPRSA-N
Literature Reference Author L.ESCHEN-LIPPOLD,T.DRAEGER,A.TEICHERT,L.WESSJOHANN,B.WESTERM ANN,S.ROSAHL,N.ARNOL
Literature Reference Citation J.AGR.FOOD.CHEM.,57,9607(2009)
Literature Reference DOI 10.1021/jf902067k
Molecular Weight 268.397 g/mol
Sample ID 68174
Solvent ACETONE-D6