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Glutaric acid, 2-methylpent-3-yl 1-naphthyl ester
SpectraBase Compound ID A1GHg3A7GDh
InChI InChI=1S/C21H26O4/c1-4-18(15(2)3)24-20(22)13-8-14-21(23)25-19-12-7-10-16-9-5-6-11-17(16)19/h5-7,9-12,15,18H,4,8,13-14H2,1-3H3
InChIKey FZHREUBARNEGGQ-UHFFFAOYSA-N
Mol Weight 342.44 g/mol
Molecular Formula C21H26O4
Exact Mass 342.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ACBvlDBgCs5
Name Glutaric acid, 2-methylpent-3-yl 1-naphthyl ester
Comments Computed using HOSE algorithm
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Exact Mass 342.183109313 u
Formula C21H26O4
InChI InChI=1S/C21H26O4/c1-4-18(15(2)3)24-20(22)13-8-14-21(23)25-19-12-7-10-16-9-5-6-11-17(16)19/h5-7,9-12,15,18H,4,8,13-14H2,1-3H3
InChIKey FZHREUBARNEGGQ-UHFFFAOYSA-N
Molecular Weight 342.435 g/mol
SMILES C(CCC(OC(CC)C(C)C)=O)C(OC=1C2=C(C=CC1)C=CC=C2)=O