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Glutaric acid, naphth-2-ylmethyl 2-propylphenyl ester
SpectraBase Compound ID SvMlS5O8L6
InChI InChI=1S/C25H26O4/c1-2-8-21-10-5-6-12-23(21)29-25(27)14-7-13-24(26)28-18-19-15-16-20-9-3-4-11-22(20)17-19/h3-6,9-12,15-17H,2,7-8,13-14,18H2,1H3
InChIKey FYXFHVIWFIQVJA-UHFFFAOYSA-N
Mol Weight 390.48 g/mol
Molecular Formula C25H26O4
Exact Mass 390.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6cvLNHVUHwG
Name Glutaric acid, naphth-2-ylmethyl 2-propylphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 390.183109313 u
Formula C25H26O4
InChI InChI=1S/C25H26O4/c1-2-8-21-10-5-6-12-23(21)29-25(27)14-7-13-24(26)28-18-19-15-16-20-9-3-4-11-22(20)17-19/h3-6,9-12,15-17H,2,7-8,13-14,18H2,1H3
InChIKey FYXFHVIWFIQVJA-UHFFFAOYSA-N
Molecular Weight 390.479 g/mol
SMILES C(CCC(OCC1=CC2=C(C=CC=C2)C=C1)=O)C(OC=1C(CCC)=CC=CC1)=O