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Sebacic acid, nonyl 2-phenylphenyl ester

View entire compound with spectra: 1 NMR

Sebacic acid, nonyl 2-phenylphenyl ester
SpectraBase Compound ID Dz1REDwxIZQ
InChI InChI=1S/C31H44O4/c1-2-3-4-5-8-11-19-26-34-30(32)24-15-9-6-7-10-16-25-31(33)35-29-23-18-17-22-28(29)27-20-13-12-14-21-27/h12-14,17-18,20-23H,2-11,15-16,19,24-26H2,1H3
InChIKey AAIHVCSKGLZVSO-UHFFFAOYSA-N
Mol Weight 480.7 g/mol
Molecular Formula C31H44O4
Exact Mass 480.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8sINgV1LozR
Name Sebacic acid, nonyl 2-phenylphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 480.323959893 u
Formula C31H44O4
InChI InChI=1S/C31H44O4/c1-2-3-4-5-8-11-19-26-34-30(32)24-15-9-6-7-10-16-25-31(33)35-29-23-18-17-22-28(29)27-20-13-12-14-21-27/h12-14,17-18,20-23H,2-11,15-16,19,24-26H2,1H3
InChIKey AAIHVCSKGLZVSO-UHFFFAOYSA-N
Molecular Weight 480.689 g/mol
SMILES C(C(OC1=CC=CC=C1C1=CC=CC=C1)=O)CCCCCCCC(OCCCCCCCCC)=O