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Glutaric acid, but-3-en-2-yl naphth-2-ylmethyl ester
SpectraBase Compound ID HhzTAB8uqvU
InChI InChI=1S/C20H22O4/c1-3-15(2)24-20(22)10-6-9-19(21)23-14-16-11-12-17-7-4-5-8-18(17)13-16/h3-5,7-8,11-13,15H,1,6,9-10,14H2,2H3
InChIKey QKJJLXLVZCAPFR-UHFFFAOYSA-N
Mol Weight 326.39 g/mol
Molecular Formula C20H22O4
Exact Mass 326.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2FPIhCDHPK
Name Glutaric acid, but-3-en-2-yl naphth-2-ylmethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 326.151809184 u
Formula C20H22O4
InChI InChI=1S/C20H22O4/c1-3-15(2)24-20(22)10-6-9-19(21)23-14-16-11-12-17-7-4-5-8-18(17)13-16/h3-5,7-8,11-13,15H,1,6,9-10,14H2,2H3
InChIKey QKJJLXLVZCAPFR-UHFFFAOYSA-N
Molecular Weight 326.392 g/mol
SMILES C(CCC(OCC1=CC2=C(C=CC=C2)C=C1)=O)C(OC(C)C=C)=O