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Phthalic acid, 1-cyclopentylethyl undecyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 1-cyclopentylethyl undecyl ester
SpectraBase Compound ID GNWA7VpSzKa
InChI InChI=1S/C26H40O4/c1-3-4-5-6-7-8-9-10-15-20-29-25(27)23-18-13-14-19-24(23)26(28)30-21(2)22-16-11-12-17-22/h13-14,18-19,21-22H,3-12,15-17,20H2,1-2H3
InChIKey OSPLLIBTFFBOBX-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C26H40O4
Exact Mass 416.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DdCGWL0aM2O
Name Phthalic acid, 1-cyclopentylethyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 416.292659764 u
Formula C26H40O4
InChI InChI=1S/C26H40O4/c1-3-4-5-6-7-8-9-10-15-20-29-25(27)23-18-13-14-19-24(23)26(28)30-21(2)22-16-11-12-17-22/h13-14,18-19,21-22H,3-12,15-17,20H2,1-2H3
InChIKey OSPLLIBTFFBOBX-UHFFFAOYSA-N
Molecular Weight 416.602 g/mol
SMILES C(OC(C1CCCC1)C)(=O)C1=CC=CC=C1C(OCCCCCCCCCCC)=O