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(E,E)-HEPTA-4,6-DIENOIC_ACID

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(E,E)-HEPTA-4,6-DIENOIC_ACID
SpectraBase Compound ID 1vJjqx15b9q
InChI InChI=1S/C7H10O2/c1-2-3-4-5-6-7(8)9/h2-4H,1,5-6H2,(H,8,9)/b4-3+
InChIKey HHLIJJJAKAFXJB-ONEGZZNKSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HkBSI8Pa2hS
Name (E,E)-HEPTA-4,6-DIENOIC_ACID
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-2-3-4-5-6-7(8)9/h2-4H,1,5-6H2,(H,8,9)/b4-3+
InChIKey HHLIJJJAKAFXJB-ONEGZZNKSA-N
Literature Reference Author L.C.BAILLIE,A.BATSANOV,J.R.BEARDER,D.A.WHITING
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3471(1998)
Literature Reference DOI 10.1039/a804664f
Molecular Weight 126.155 g/mol
Solvent CDCl3
Source File Reference UWBS744