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(1-PHENYLBUTYL)-PROPANEDIOIC_ACID
SpectraBase Compound ID CgYx7rnpInt
InChI InChI=1S/C13H16O4/c1-2-6-10(9-7-4-3-5-8-9)11(12(14)15)13(16)17/h3-5,7-8,10-11H,2,6H2,1H3,(H,14,15)(H,16,17)
InChIKey BQVGXCMSKVYPAA-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 8tBMXyVLlas
Name (1-Phenyl-butyl)-malonic acid
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-2-6-10(9-7-4-3-5-8-9)11(12(14)15)13(16)17/h3-5,7-8,10-11H,2,6H2,1H3,(H,14,15)(H,16,17)
InChIKey BQVGXCMSKVYPAA-UHFFFAOYSA-N
Instrument Name Bruker AM-300
Literature Reference A. Patra, S.K. Misra, Magn. Res. Chem. 29, 749 (1991).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6