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Octyl-succinic acid, dimethyl ester
SpectraBase Compound ID GPd2bKqaaDV
InChI InChI=1S/C14H26O4/c1-4-5-6-7-8-9-10-12(14(16)18-3)11-13(15)17-2/h12H,4-11H2,1-3H3
InChIKey CCOPEMWZRCNTPI-UHFFFAOYSA-N
Mol Weight 258.36 g/mol
Molecular Formula C14H26O4
Exact Mass 258.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LO2QhHURdHu
Name Octyl-succinic acid, dimethyl ester
CAS Registry Number 56425-00-4
Comments SHIFTVALUE FOR C12 IS CHANGED FROM 12.20 TO 14.20 PPM (A.H.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H26O4
InChI InChI=1S/C14H26O4/c1-4-5-6-7-8-9-10-12(14(16)18-3)11-13(15)17-2/h12H,4-11H2,1-3H3
InChIKey CCOPEMWZRCNTPI-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference D.E. James, J.K. Stille, J. Org. Chem. 41, 1504 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3