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3-BUTANOYLTETRONIC-ACID;TAUTOMER-AB
SpectraBase Compound ID HKPFGhiwdVy
InChI InChI=1S/C8H10O4/c1-2-3-5(9)7-6(10)4-12-8(7)11/h10H,2-4H2,1H3
InChIKey APBVMBGACWPRMQ-UHFFFAOYSA-N
Mol Weight 170.16 g/mol
Molecular Formula C8H10O4
Exact Mass 170.057909 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8tnZ5EVKPtI
Name 3-BUTANOYLTETRONIC-ACID;TAUTOMER-CD
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H10O4
InChI InChI=1S/C8H10O4/c1-2-3-5(9)7-6(10)4-12-8(7)11/h10H,2-4H2,1H3
InChIKey APBVMBGACWPRMQ-UHFFFAOYSA-N
Literature Reference Author C.MITSOS,A.ZOGRAFOS,O.IGGLESSI-MARKOPOULOU
Literature Reference Citation J.HETCYCL.CHEM.,39,1201(2002)
Literature Reference DOI 10.1002/jhet.5570390614
Molecular Weight 170.165 g/mol
Solvent CDCl3
Source File Reference UWSI20821