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Phthalic acid, 1-cyclopentylethyl nonyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 1-cyclopentylethyl nonyl ester
SpectraBase Compound ID J3MeNlPbmuo
InChI InChI=1S/C24H36O4/c1-3-4-5-6-7-8-13-18-27-23(25)21-16-11-12-17-22(21)24(26)28-19(2)20-14-9-10-15-20/h11-12,16-17,19-20H,3-10,13-15,18H2,1-2H3
InChIKey VUSJBAIKCYYRPC-UHFFFAOYSA-N
Mol Weight 388.5 g/mol
Molecular Formula C24H36O4
Exact Mass 388.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DowSoKX0OGf
Name Phthalic acid, 1-cyclopentylethyl nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 388.261359635 u
Formula C24H36O4
InChI InChI=1S/C24H36O4/c1-3-4-5-6-7-8-13-18-27-23(25)21-16-11-12-17-22(21)24(26)28-19(2)20-14-9-10-15-20/h11-12,16-17,19-20H,3-10,13-15,18H2,1-2H3
InChIKey VUSJBAIKCYYRPC-UHFFFAOYSA-N
Molecular Weight 388.548 g/mol
SMILES C1(=C(C=CC=C1)C(OC(C1CCCC1)C)=O)C(OCCCCCCCCC)=O