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1-(2-Methylpropyl)-2,3,5-tris(4-hydroxyphenyl)-1H-pyrrole
SpectraBase Compound ID IsVdMKEkki5
InChI InChI=1S/C26H25NO3/c1-17(2)16-27-25(19-5-11-22(29)12-6-19)15-24(18-3-9-21(28)10-4-18)26(27)20-7-13-23(30)14-8-20/h3-15,17,28-30H,16H2,1-2H3
InChIKey XJWOSGJBXUWBIL-UHFFFAOYSA-N
Mol Weight 399.49 g/mol
Molecular Formula C26H25NO3
Exact Mass 399.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBB1XRiyZwq
Name 1-(2-Methylpropyl)-2,3,5-tris(4-hydroxyphenyl)-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H25NO3
InChI InChI=1S/C26H25NO3/c1-17(2)16-27-25(19-5-11-22(29)12-6-19)15-24(18-3-9-21(28)10-4-18)26(27)20-7-13-23(30)14-8-20/h3-15,17,28-30H,16H2,1-2H3
InChIKey XJWOSGJBXUWBIL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.201100283
Molecular Weight 399.490 g/mol
SMILES Oc1ccc(-c2cc(-c3ccc(cc3)O)[n](c2-c2ccc(cc2)O)CC(C)C)cc1
SPLASH splash10-0007-9208200000-ab202af33403a116d6db
Source of Spectrum CMC-6-2060-5d
Synonyms 4,4',4''-(1-isobutyl-1H-pyrrole-2,3,5-triyl)triphenol 4-[4,5-bis(4-hydroxyphenyl)-1-(2-methylpropyl)-2-pyrrolyl]phenol 4-[4,5-bis(4-hydroxyphenyl)-1-(2-methylpropyl)pyrrol-2-yl]phenol
Wiley ID 1771735