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Diethylmalonic acid, 2,6-dimethoxyphenyl nonyl ester
SpectraBase Compound ID Kr18sdpXTG4
InChI InChI=1S/C24H38O6/c1-6-9-10-11-12-13-14-18-29-22(25)24(7-2,8-3)23(26)30-21-19(27-4)16-15-17-20(21)28-5/h15-17H,6-14,18H2,1-5H3
InChIKey YAWOELZFWWBZEX-UHFFFAOYSA-N
Mol Weight 422.6 g/mol
Molecular Formula C24H38O6
Exact Mass 422.266839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JTQC5pDrXM
Name Diethylmalonic acid, 2,6-dimethoxyphenyl nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.266838938 u
Formula C24H38O6
InChI InChI=1S/C24H38O6/c1-6-9-10-11-12-13-14-18-29-22(25)24(7-2,8-3)23(26)30-21-19(27-4)16-15-17-20(21)28-5/h15-17H,6-14,18H2,1-5H3
InChIKey YAWOELZFWWBZEX-UHFFFAOYSA-N
Molecular Weight 422.562 g/mol
SMILES COC1=C(C(=CC=C1)OC)OC(C(C(OCCCCCCCCC)=O)(CC)CC)=O