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(1'R,2R,3R)-2-(1'-HYDROXYETHYL)-3-METHYLHEPTANOIC-ACID
SpectraBase Compound ID KgMYry55j1I
InChI InChI=1S/C10H20O3/c1-4-5-6-7(2)9(8(3)11)10(12)13/h7-9,11H,4-6H2,1-3H3,(H,12,13)/t7-,8-,9+/m1/s1
InChIKey WYOVZLRNBXVPHM-HLTSFMKQSA-N
Mol Weight 188.27 g/mol
Molecular Formula C10H20O3
Exact Mass 188.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AV0vjFwXizs
Name (1'R,2R,3R)-2-(1'-HYDROXYETHYL)-3-METHYLHEPTANOIC-ACID
CAS Registry Number 129287-82-7
Compound Number 47
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H20O3
InChI InChI=1S/C10H20O3/c1-4-5-6-7(2)9(8(3)11)10(12)13/h7-9,11H,4-6H2,1-3H3,(H,12,13)/t7-,8-,9+/m1/s1
InChIKey WYOVZLRNBXVPHM-HLTSFMKQSA-N
Literature Reference Author W.AMBERG,D.SEEBACH
Literature Reference Citation CHEM.BER.,123,2413(1990)
Literature Reference DOI 10.1002/cber.19901231225
Molecular Weight 188.267 g/mol
Solvent CDCl3
Source File Reference UWED12685