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ALPHA-ISOPROPYLMALIC-ACID
SpectraBase Compound ID 9wgG8Vzi976
InChI InChI=1S/C7H12O5/c1-4(2)7(12,6(10)11)3-5(8)9/h4,12H,3H2,1-2H3,(H,8,9)(H,10,11)/t7-/m1/s1
InChIKey BITYXLXUCSKTJS-SSDOTTSWSA-N
Mol Weight 176.17 g/mol
Molecular Formula C7H12O5
Exact Mass 176.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Q66O6Ha93y
Name ALPHA-ISOPROPYLMALIC-ACID
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O5
InChI InChI=1S/C7H12O5/c1-4(2)7(12,6(10)11)3-5(8)9/h4,12H,3H2,1-2H3,(H,8,9)(H,10,11)/t7-/m1/s1
InChIKey BITYXLXUCSKTJS-SSDOTTSWSA-N
Literature Reference Author R.NISHIDA,C.S.KIM,H.FUKAMI,R.IRIE
Literature Reference Citation AGR.BIOL.CHEM.,55,1787(1991)
Literature Reference DOI 10.1271/bbb1961.55.1787
Molecular Weight 176.169 g/mol
Solvent D2O
Source File Reference UWBT7771