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(2RS, 3RS,4RS)-2,4-Dimethyl-3-hydroxy-2-methoxy-heptane-1,7-dioic acid, dimethyl ester
SpectraBase Compound ID 19xjHqZEr4c
InChI InChI=1S/C12H22O6/c1-8(6-7-9(13)16-3)10(14)12(2,18-5)11(15)17-4/h8,10,14H,6-7H2,1-5H3
InChIKey OXXWNBXSBVMACK-UHFFFAOYSA-N
Mol Weight 262.3 g/mol
Molecular Formula C12H22O6
Exact Mass 262.141638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ziIFquwYYk
Name (2RS, 3RS,4RS)-2,4-Dimethyl-3-hydroxy-2-methoxy-heptane-1,7-dioic acid, dimethyl ester
CAS Registry Number 79026-94-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H22O6
InChI InChI=1S/C12H22O6/c1-8(6-7-9(13)16-3)10(14)12(2,18-5)11(15)17-4/h8,10,14H,6-7H2,1-5H3
InChIKey OXXWNBXSBVMACK-UHFFFAOYSA-N
Literature Reference C.H. Heathcock, M.C. Pirrung, S.D.Young, J. Am. Chem. Soc. 106, 8161 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3