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beta-Hydroxy-beta-methylglutaric acid

View entire compound with spectra: 11 NMR, 4 FTIR, and 1 Raman

beta-Hydroxy-beta-methylglutaric acid
SpectraBase Compound ID 8VUh2tSfuJu
InChI InChI=1S/C6H10O5/c1-6(11,2-4(7)8)3-5(9)10/h11H,2-3H2,1H3,(H,7,8)(H,9,10)
InChIKey NPOAOTPXWNWTSH-UHFFFAOYSA-N
Mol Weight 162.14 g/mol
Molecular Formula C6H10O5
Exact Mass 162.052823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8jPqsLq4pe5
Name 3-HYDROXY-3-METHYL-GLUTARIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H10O5
InChI InChI=1S/C6H10O5/c1-6(11,2-4(7)8)3-5(9)10/h11H,2-3H2,1H3,(H,7,8)(H,9,10)
InChIKey NPOAOTPXWNWTSH-UHFFFAOYSA-N
Literature Reference Author M.A.DUBOIS,M.WIERER,H.WAGNER
Literature Reference Citation PHYTOCHEM.,29,3369(1990)
Literature Reference DOI 10.1016/0031-9422(90)80221-2
Molecular Weight 162.142 g/mol
Solvent DMSO-D6:TFA-D6
Source File Reference UWLU26833