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PHENYL-3,5,5-TRIPHENYLPENTA-3,4-DIENOATE

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PHENYL-3,5,5-TRIPHENYLPENTA-3,4-DIENOATE
SpectraBase Compound ID BBWe3fRnCBX
InChI InChI=1S/C29H22O2/c30-29(31-27-19-11-4-12-20-27)22-26(23-13-5-1-6-14-23)21-28(24-15-7-2-8-16-24)25-17-9-3-10-18-25/h1-20H,22H2
InChIKey QBIRJDICORNYOZ-UHFFFAOYSA-N
Mol Weight 402.49 g/mol
Molecular Formula C29H22O2
Exact Mass 402.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CCDJyY6SwLY
Name PHENYL-3,5,5-TRIPHENYLPENTA-3,4-DIENOATE
Compound Number 7K D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H22O2
InChI InChI=1S/C29H22O2/c30-29(31-27-19-11-4-12-20-27)22-26(23-13-5-1-6-14-23)21-28(24-15-7-2-8-16-24)25-17-9-3-10-18-25/h1-20H,22H2
InChIKey QBIRJDICORNYOZ-UHFFFAOYSA-N
Literature Reference Author I.MATSUDA,K.I.KOMORI,K.ITOH
Literature Reference Citation J.AM.CHEM.SOC.,124,9072(2002)
Literature Reference DOI 10.1021/ja0264089
Molecular Weight 402.492 g/mol
Sample ID 34097
Solvent CDCl3