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[3,4-(13)C2]-2-BUTYNOIC-ACID

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[3,4-(13)C2]-2-BUTYNOIC-ACID
SpectraBase Compound ID L6yEEJ1tzm4
InChI InChI=1S/C4H4O2/c1-2-3-4(5)6/h1H3,(H,5,6)/i1+1,2+1
InChIKey LUEHNHVFDCZTGL-ZDOIIHCHSA-N
Mol Weight 86.06 g/mol
Molecular Formula C213C2H4O2
Exact Mass 86.027839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FrDG6h3AOar
Name [3,4-(13)C2]-2-BUTYNOIC-ACID
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H4O2
InChI InChI=1S/C4H4O2/c1-2-3-4(5)6/h1H3,(H,5,6)/i1+1,2+1
InChIKey LUEHNHVFDCZTGL-ZDOIIHCHSA-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 84.075 g/mol
Sample ID 53541
Solvent CDCl3