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2-Methoxycarbonyl-3-phenyl-2-pentenoic acid, G-lactone
SpectraBase Compound ID KbsfC2b9QO8
InChI InChI=1S/C13H12O4/c1-8-10(9-6-4-3-5-7-9)11(12(14)16-2)13(15)17-8/h3-8H,1-2H3
InChIKey MILVVALDWMFUGH-UHFFFAOYSA-N
Mol Weight 232.23 g/mol
Molecular Formula C13H12O4
Exact Mass 232.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DnmCMj9mahk
Name 2-Methoxycarbonyl-3-phenyl-2-pentenoic acid, G-lactone
CAS Registry Number 69231-25-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H12O4
InChI InChI=1S/C13H12O4/c1-8-10(9-6-4-3-5-7-9)11(12(14)16-2)13(15)17-8/h3-8H,1-2H3
InChIKey MILVVALDWMFUGH-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference A.S. Berg, P. Kolsaker, Acta Chem. Scand. B32, 665 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3