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2-phenylbutyric acid, magnesium salt, monohydrate
SpectraBase Compound ID 9xE9glu2d1t
InChI InChI=1S/2C10H12O2.Mg.H2O/c2*1-2-9(10(11)12)8-6-4-3-5-7-8;;/h2*3-7,9H,2H2,1H3,(H,11,12);;1H2/q;;+2;/p-2
InChIKey CJVUCGWHYZWJAA-UHFFFAOYSA-L
Mol Weight 368.712 g/mol
Molecular Formula C20H24MgO5
Exact Mass 368.147416 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DRcYSriY39M
Name 2-phenylbutyric acid, magnesium salt, monohydrate
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24MgO5
InChI InChI=1S/2C10H12O2.Mg.H2O/c2*1-2-9(10(11)12)8-6-4-3-5-7-8;;/h2*3-7,9H,2H2,1H3,(H,11,12);;1H2/q;;+2;/p-2
InChIKey CJVUCGWHYZWJAA-UHFFFAOYSA-L
Instrument Name Varian CFT-20
Sadtler NMR Number 33652M
Solvent Polysol