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4-[2,5-bis(3,5-dibromo-4-hydroxy-benzyl)-4-(3,5-dibromo-4-hydroxy-phenyl)-1-[2-(4-hydroxyphenyl)ethyl]pyrrol-3-yl]-2,6-dibromo-phenol

View entire compound with spectra: 1 NMR

4-[2,5-bis(3,5-dibromo-4-hydroxy-benzyl)-4-(3,5-dibromo-4-hydroxy-phenyl)-1-[2-(4-hydroxyphenyl)ethyl]pyrrol-3-yl]-2,6-dibromo-phenol
SpectraBase Compound ID 2ug6o8VhfgV
InChI InChI=1S/C38H25Br8NO5/c39-23-7-18(8-24(40)35(23)49)11-31-33(20-13-27(43)37(51)28(44)14-20)34(21-15-29(45)38(52)30(46)16-21)32(12-19-9-25(41)36(50)26(42)10-19)47(31)6-5-17-1-3-22(48)4-2-17/h1-4,7-10,13-16,48-52H,5-6,11-12H2
InChIKey XATMSTABCPTBFH-UHFFFAOYSA-N
Mol Weight 1214.9 g/mol
Molecular Formula C38H25Br8NO5
Exact Mass 1206.519977 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1mUnHl94K6v
Name 4-[2,5-bis(3,5-dibromo-4-hydroxy-benzyl)-4-(3,5-dibromo-4-hydroxy-phenyl)-1-[2-(4-hydroxyphenyl)ethyl]pyrrol-3-yl]-2,6-dibromo-phenol
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H25Br8NO5
InChI InChI=1S/C38H25Br8NO5/c39-23-7-18(8-24(40)35(23)49)11-31-33(20-13-27(43)37(51)28(44)14-20)34(21-15-29(45)38(52)30(46)16-21)32(12-19-9-25(41)36(50)26(42)10-19)47(31)6-5-17-1-3-22(48)4-2-17/h1-4,7-10,13-16,48-52H,5-6,11-12H2
InChIKey XATMSTABCPTBFH-UHFFFAOYSA-N
Literature Reference Author A.RUDI,I.GOLDBERG,Z.STEIN,F.FROLOW,Y.BENAYAHU,M.SCHLEYER,Y.K ASHMAN
Literature Reference Citation J.ORG.CHEM.,59,999(1994)
Literature Reference DOI 10.1021/jo00084a015
Molecular Weight 1214.852 g/mol
Solvent CDCl3
Source File Reference UWCP4928