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Glutaric acid, naphth-2-ylmethyl isobutyl ester
SpectraBase Compound ID GIZU8xPbQZ3
InChI InChI=1S/C20H24O4/c1-15(2)13-23-19(21)8-5-9-20(22)24-14-16-10-11-17-6-3-4-7-18(17)12-16/h3-4,6-7,10-12,15H,5,8-9,13-14H2,1-2H3
InChIKey XEAJYTJFIKOCBQ-UHFFFAOYSA-N
Mol Weight 328.41 g/mol
Molecular Formula C20H24O4
Exact Mass 328.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5yUjHJ3gq5H
Name Glutaric acid, naphth-2-ylmethyl isobutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 328.167459249 u
Formula C20H24O4
InChI InChI=1S/C20H24O4/c1-15(2)13-23-19(21)8-5-9-20(22)24-14-16-10-11-17-6-3-4-7-18(17)12-16/h3-4,6-7,10-12,15H,5,8-9,13-14H2,1-2H3
InChIKey XEAJYTJFIKOCBQ-UHFFFAOYSA-N
Molecular Weight 328.408 g/mol
SMILES C(CCC(OCC1=CC2=C(C=CC=C2)C=C1)=O)C(OCC(C)C)=O