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(E)-4-[5,7-Di-tert-butyl-3-(2-phenylethen-1-yl)benzofuran-2-yl]benzoic Acid
SpectraBase Compound ID DTidQS9nB86
InChI InChI=1S/C31H32O3/c1-30(2,3)23-18-25-24(17-12-20-10-8-7-9-11-20)27(21-13-15-22(16-14-21)29(32)33)34-28(25)26(19-23)31(4,5)6/h7-19H,1-6H3,(H,32,33)/b17-12+
InChIKey QRBHSFXCLDKEID-SFQUDFHCSA-N
Mol Weight 452.6 g/mol
Molecular Formula C31H32O3
Exact Mass 452.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Bt1KEZJyjP
Name (E)-4-[5,7-Di-tert-butyl-3-(2-phenylethen-1-yl)benzofuran-2-yl]benzoic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H32O3
InChI InChI=1S/C31H32O3/c1-30(2,3)23-18-25-24(17-12-20-10-8-7-9-11-20)27(21-13-15-22(16-14-21)29(32)33)34-28(25)26(19-23)31(4,5)6/h7-19H,1-6H3,(H,32,33)/b17-12+
InChIKey QRBHSFXCLDKEID-SFQUDFHCSA-N
Literature Reference DOI 10.1002/cmdc.200900015
Molecular Weight 452.594 g/mol
SMILES OC(=O)c1ccc(cc1)-c1oc2c(c1\C=C\c1ccccc1)cc(cc2C(C)(C)C)C(C)(C)C
SPLASH splash10-0f81-9200700000-acb2b8c8b12b783d1eff
Source of Spectrum CMC-4-780/SM8-12g
Synonyms (E)-4-(5,7-di-tert-butyl-3-styrylbenzofuran-2-yl)benzoic acid
Wiley ID 1771613