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Sebacic acid, di(3-phenylallyl) ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Sebacic acid, di(3-phenylallyl) ester
SpectraBase Compound ID JU7RVt4fmNF
InChI InChI=1S/C28H34O4/c29-27(31-23-13-19-25-15-7-5-8-16-25)21-11-3-1-2-4-12-22-28(30)32-24-14-20-26-17-9-6-10-18-26/h5-10,13-20H,1-4,11-12,21-24H2/b19-13+,20-14+
InChIKey GEUAXRVMFGKGNL-IWGRKNQJSA-N
Mol Weight 434.6 g/mol
Molecular Formula C28H34O4
Exact Mass 434.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7rlVUu1rT9o
Name Sebacic acid, di(3-phenylallyl) ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.245709571 u
Formula C28H34O4
InChI InChI=1S/C28H34O4/c29-27(31-23-13-19-25-15-7-5-8-16-25)21-11-3-1-2-4-12-22-28(30)32-24-14-20-26-17-9-6-10-18-26/h5-10,13-20H,1-4,11-12,21-24H2/b19-13+,20-14+
InChIKey GEUAXRVMFGKGNL-IWGRKNQJSA-N
Molecular Weight 434.576 g/mol
SMILES C(C(OC\C=C\C1=CC=CC=C1)=O)CCCCCCCC(OC\C=C\C1=CC=CC=C1)=O