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4-Phenoxy-muconic acid, mono phenyl ester

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4-Phenoxy-muconic acid, mono phenyl ester
SpectraBase Compound ID CiusxA6z2sm
InChI InChI=1S/C18H14O5/c19-17(20)13-16(22-14-7-3-1-4-8-14)11-12-18(21)23-15-9-5-2-6-10-15/h1-13H,(H,19,20)/b12-11-,16-13+
InChIKey FLXNAOQVNXXVHW-PAZXJHTRSA-N
Mol Weight 310.31 g/mol
Molecular Formula C18H14O5
Exact Mass 310.084124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 53p6NZ5oL8B
Name 4-Phenoxy-muconic acid, mono phenyl ester
CAS Registry Number 79144-39-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H14O5
InChI InChI=1S/C18H14O5/c19-17(20)13-16(22-14-7-3-1-4-8-14)11-12-18(21)23-15-9-5-2-6-10-15/h1-13H,(H,19,20)/b12-11-,16-13+
InChIKey FLXNAOQVNXXVHW-PAZXJHTRSA-N
Instrument Name Varian CFT-20
Literature Reference T.R. Demmin, M.D. Swerdloff, M.M.Rogic, J. Am. Chem. Soc. 103, 5795 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3