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2,5-Dibromo-3,4-bis(4-methoxyphenyl)-1-[2-(4-methoxyphenyl)ethyl]pyrrole
SpectraBase Compound ID 72GddlXk62v
InChI InChI=1S/C27H25Br2NO3/c1-31-21-10-4-18(5-11-21)16-17-30-26(28)24(19-6-12-22(32-2)13-7-19)25(27(30)29)20-8-14-23(33-3)15-9-20/h4-15H,16-17H2,1-3H3
InChIKey KGUSDHJZUCOMPU-UHFFFAOYSA-N
Mol Weight 571.31 g/mol
Molecular Formula C27H25Br2NO3
Exact Mass 569.02012 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1aMSqEPRvXM
Name 2,5-Dibromo-3,4-bis(4-methoxyphenyl)-1-[2-(4-methoxyphenyl)ethyl]pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H25Br2NO3
InChI InChI=1S/C27H25Br2NO3/c1-31-21-10-4-18(5-11-21)16-17-30-26(28)24(19-6-12-22(32-2)13-7-19)25(27(30)29)20-8-14-23(33-3)15-9-20/h4-15H,16-17H2,1-3H3
InChIKey KGUSDHJZUCOMPU-UHFFFAOYSA-N
Molecular Weight 571.309 g/mol
SMILES c1([n](c(c(c1-c1ccc(cc1)OC)-c1ccc(cc1)OC)Br)CCc1ccc(cc1)OC)Br
SPLASH splash10-00dl-0101690000-f9b5cdd78159e9735657
Source of Spectrum F4-0-3046-5
Synonyms 2,5-Dibromo-3,4-bis(4-methoxyphenyl)-1-[2-(4-methoxyphenyl)ethyl]-1H-pyrrole
Wiley ID 1620610