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Glutaric acid, naphth-2-ylmethyl pent-4-en-2-yl ester
SpectraBase Compound ID JETZxnRl443
InChI InChI=1S/C21H24O4/c1-3-7-16(2)25-21(23)11-6-10-20(22)24-15-17-12-13-18-8-4-5-9-19(18)14-17/h3-5,8-9,12-14,16H,1,6-7,10-11,15H2,2H3
InChIKey KLJALDDQFRTOPG-UHFFFAOYSA-N
Mol Weight 340.42 g/mol
Molecular Formula C21H24O4
Exact Mass 340.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hVXPJ3nHqP
Name Glutaric acid, naphth-2-ylmethyl pent-4-en-2-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 340.167459249 u
Formula C21H24O4
InChI InChI=1S/C21H24O4/c1-3-7-16(2)25-21(23)11-6-10-20(22)24-15-17-12-13-18-8-4-5-9-19(18)14-17/h3-5,8-9,12-14,16H,1,6-7,10-11,15H2,2H3
InChIKey KLJALDDQFRTOPG-UHFFFAOYSA-N
Molecular Weight 340.419 g/mol
SMILES C(CCC(OCC1=CC2=C(C=CC=C2)C=C1)=O)C(OC(C)CC=C)=O