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Diethylmalonic acid, 2-methoxyphenyl pentadecyl ester

View entire compound with spectra: 1 NMR

Diethylmalonic acid, 2-methoxyphenyl pentadecyl ester
SpectraBase Compound ID By7aU1IiPle
InChI InChI=1S/C29H48O5/c1-5-8-9-10-11-12-13-14-15-16-17-18-21-24-33-27(30)29(6-2,7-3)28(31)34-26-23-20-19-22-25(26)32-4/h19-20,22-23H,5-18,21,24H2,1-4H3
InChIKey ZYPKJMROUKBAIF-UHFFFAOYSA-N
Mol Weight 476.7 g/mol
Molecular Formula C29H48O5
Exact Mass 476.350175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Afio7RBc1O
Name Diethylmalonic acid, 2-methoxyphenyl pentadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 476.350174641 u
Formula C29H48O5
InChI InChI=1S/C29H48O5/c1-5-8-9-10-11-12-13-14-15-16-17-18-21-24-33-27(30)29(6-2,7-3)28(31)34-26-23-20-19-22-25(26)32-4/h19-20,22-23H,5-18,21,24H2,1-4H3
InChIKey ZYPKJMROUKBAIF-UHFFFAOYSA-N
Molecular Weight 476.698 g/mol
SMILES CCC(C(OCCCCCCCCCCCCCCC)=O)(C(OC1=C(C=CC=C1)OC)=O)CC