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TRANS-3,4-EPOXY-5-HEXENOIC-ACID

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TRANS-3,4-EPOXY-5-HEXENOIC-ACID
SpectraBase Compound ID 7kT5lE9YSx
InChI InChI=1S/C6H8O3/c1-2-4-5(9-4)3-6(7)8/h2,4-5H,1,3H2,(H,7,8)/t4-,5-/m0/s1
InChIKey ZQOISUAETPFTAA-WHFBIAKZSA-N
Mol Weight 128.13 g/mol
Molecular Formula C6H8O3
Exact Mass 128.047344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IvjPALfMCNf
Name TRANS-3,4-EPOXY-5-HEXENOIC-ACID
Compound Number 14
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H8O3
InChI InChI=1S/C6H8O3/c1-2-4-5(9-4)3-6(7)8/h2,4-5H,1,3H2,(H,7,8)/t4-,5-/m0/s1
InChIKey ZQOISUAETPFTAA-WHFBIAKZSA-N
Literature Reference Author S.DAKOJI,I.SHIN,D.F.BECKER,M.T.STANKOVICH,H.W.LIU
Literature Reference Citation J.AM.CHEM.SOC.,118,10971(1996)
Literature Reference DOI 10.1021/ja962532e
Molecular Weight 128.128 g/mol
Sample ID 53538
Solvent CDCl3