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3,4-Bis(4-hydroxyphenyl)-1-[2-(4-hydroxyphenyl)ethyl]-2,5-bis(4-hydroxybenzoyl)pyrrole
SpectraBase Compound ID 9WQkgirDVvY
InChI InChI=1S/C38H29NO7/c40-28-11-1-23(2-12-28)21-22-39-35(37(45)26-7-17-31(43)18-8-26)33(24-3-13-29(41)14-4-24)34(25-5-15-30(42)16-6-25)36(39)38(46)27-9-19-32(44)20-10-27/h1-20,40-44H,21-22H2
InChIKey RXMGYOJGSIMXJY-UHFFFAOYSA-N
Mol Weight 611.7 g/mol
Molecular Formula C38H29NO7
Exact Mass 611.194402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXbD3aWfXuQ
Name 3,4-Bis(4-hydroxyphenyl)-1-[2-(4-hydroxyphenyl)ethyl]-2,5-bis(4-hydroxybenzoyl)pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H29NO7
InChI InChI=1S/C38H29NO7/c40-28-11-1-23(2-12-28)21-22-39-35(37(45)26-7-17-31(43)18-8-26)33(24-3-13-29(41)14-4-24)34(25-5-15-30(42)16-6-25)36(39)38(46)27-9-19-32(44)20-10-27/h1-20,40-44H,21-22H2
InChIKey RXMGYOJGSIMXJY-UHFFFAOYSA-N
Molecular Weight 611.650 g/mol
SMILES Oc1ccc(C(c2[n](c(C(c3ccc(cc3)O)=O)c(c2-c2ccc(cc2)O)-c2ccc(cc2)O)CCc2ccc(cc2)O)=O)cc1
SPLASH splash10-01vo-6746902000-9bf6608133f0540bd64a
Source of Spectrum F4-0-3047-10
Synonyms {5-(4-hydroxybenzoyl)-3,4-bis(4-hydroxyphenyl)-1-[2-(4-hydroxyphenyl)ethyl]-1H-pyrrol-2-yl}(4-hydroxyphenyl)methanone
Wiley ID 1620603