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Diethylmalonic acid, hexyl 1-naphthyl ester

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Diethylmalonic acid, hexyl 1-naphthyl ester
SpectraBase Compound ID AXX1hGezrce
InChI InChI=1S/C23H30O4/c1-4-7-8-11-17-26-21(24)23(5-2,6-3)22(25)27-20-16-12-14-18-13-9-10-15-19(18)20/h9-10,12-16H,4-8,11,17H2,1-3H3
InChIKey RYWONXSKKAGJFN-UHFFFAOYSA-N
Mol Weight 370.49 g/mol
Molecular Formula C23H30O4
Exact Mass 370.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L58wMSzc3i6
Name Diethylmalonic acid, hexyl 1-naphthyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.214409442 u
Formula C23H30O4
InChI InChI=1S/C23H30O4/c1-4-7-8-11-17-26-21(24)23(5-2,6-3)22(25)27-20-16-12-14-18-13-9-10-15-19(18)20/h9-10,12-16H,4-8,11,17H2,1-3H3
InChIKey RYWONXSKKAGJFN-UHFFFAOYSA-N
Molecular Weight 370.489 g/mol
SMILES CCC(C(OCCCCCC)=O)(C(OC1=C2C(=CC=C1)C=CC=C2)=O)CC