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(2S,3R)-[3-2H1]-MALIC ACID;METHOD-A
SpectraBase Compound ID 4Y8YoWkL18I
InChI InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)/t2-/m0/s1/i1D/t1-,2+/m1
InChIKey BJEPYKJPYRNKOW-PJDMKHIJSA-N
Mol Weight 135.09 g/mol
Molecular Formula C4H52HO5
Exact Mass 135.0278 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HRpM4ofh7Ps
Name (2S,3R)-[3-2H1]-MALIC ACID;METHOD-A
Compound Number 5
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)/t2-/m0/s1/i1D/t1-,2+/m1
InChIKey BJEPYKJPYRNKOW-PJDMKHIJSA-N
Literature Reference J.CHEM.SOC.PERKIN-1,807(1994) B.S.AXELSSON,K.J.OTOOLE,P.A.SPENCER,D.W.YOUNG
Solvent NaOD:Deuterium oxide(1:9)