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4-METHYL-3-OXAHEPT-6-ENOIC-ACID
SpectraBase Compound ID Yib5kQqWM6
InChI InChI=1S/C7H12O3/c1-3-4-6(2)10-5-7(8)9/h3,6H,1,4-5H2,2H3,(H,8,9)
InChIKey OKAQUNCONVSXCD-UHFFFAOYSA-N
Mol Weight 144.17 g/mol
Molecular Formula C7H12O3
Exact Mass 144.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2nYcBa6f806
Name 4-METHYL-3-OXAHEPT-6-ENOIC-ACID
Compound Number 31AA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O3
InChI InChI=1S/C7H12O3/c1-3-4-6(2)10-5-7(8)9/h3,6H,1,4-5H2,2H3,(H,8,9)
InChIKey OKAQUNCONVSXCD-UHFFFAOYSA-N
Literature Reference Author M.B.GRAVESTOCK,D.W.KNIGHT,J.S.LOVELL,S.R.THORNTON
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3143(1999)
Literature Reference DOI 10.1039/a905802h
Molecular Weight 144.170 g/mol
Solvent CDCl3
Source File Reference UWRU7623