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4-(4-ETHOXY-4-OXOBUTYL)-BENZOIC-ACID

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4-(4-ETHOXY-4-OXOBUTYL)-BENZOIC-ACID
SpectraBase Compound ID CfWNvJI4PXt
InChI InChI=1S/C13H16O4/c1-2-17-12(14)5-3-4-10-6-8-11(9-7-10)13(15)16/h6-9H,2-5H2,1H3,(H,15,16)
InChIKey NRXNZNNOATXJBU-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DqaI3WNv1iN
Name 4-(4-ETHOXY-4-OXOBUTYL)-BENZOIC-ACID
Compound Number 14F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-2-17-12(14)5-3-4-10-6-8-11(9-7-10)13(15)16/h6-9H,2-5H2,1H3,(H,15,16)
InChIKey NRXNZNNOATXJBU-UHFFFAOYSA-N
Literature Reference Author A.BRAMBORG,T.LINKER
Literature Reference Citation EUR.J.ORG.CHEM.,2012,5552(2012)
Literature Reference DOI 10.1002/ejoc.201200823
Molecular Weight 236.268 g/mol
Solvent CDCl3
Source File Reference UWLU83556