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Sebacic acid, 2-phenylphenyl undecyl ester

View entire compound with spectra: 1 NMR

Sebacic acid, 2-phenylphenyl undecyl ester
SpectraBase Compound ID DSIF8KrP8Rb
InChI InChI=1S/C33H48O4/c1-2-3-4-5-6-7-10-13-21-28-36-32(34)26-17-11-8-9-12-18-27-33(35)37-31-25-20-19-24-30(31)29-22-15-14-16-23-29/h14-16,19-20,22-25H,2-13,17-18,21,26-28H2,1H3
InChIKey GVIMBFLVTXGIJE-UHFFFAOYSA-N
Mol Weight 508.7 g/mol
Molecular Formula C33H48O4
Exact Mass 508.35526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JnOXCRlC8tF
Name Sebacic acid, 2-phenylphenyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 508.355260022 u
Formula C33H48O4
InChI InChI=1S/C33H48O4/c1-2-3-4-5-6-7-10-13-21-28-36-32(34)26-17-11-8-9-12-18-27-33(35)37-31-25-20-19-24-30(31)29-22-15-14-16-23-29/h14-16,19-20,22-25H,2-13,17-18,21,26-28H2,1H3
InChIKey GVIMBFLVTXGIJE-UHFFFAOYSA-N
Molecular Weight 508.743 g/mol
SMILES C(C(OC1=CC=CC=C1C1=CC=CC=C1)=O)CCCCCCCC(OCCCCCCCCCCC)=O