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3-bromanyl-4-[2-[4-(1H-indol-2-yl)butyl]-1H-indol-3-yl]-1-methyl-pyrrole-2,5-dione
SpectraBase Compound ID LXioCed2HZR
InChI InChI=1S/C25H22BrN3O2/c1-29-24(30)22(23(26)25(29)31)21-17-10-4-7-12-19(17)28-20(21)13-6-3-9-16-14-15-8-2-5-11-18(15)27-16/h2,4-5,7-8,10-12,14,27-28H,3,6,9,13H2,1H3
InChIKey ZXTNTJHOHDWCOS-UHFFFAOYSA-N
Mol Weight 476.37 g/mol
Molecular Formula C25H22BrN3O2
Exact Mass 475.08954 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgUCh4sFCvF
Name 3-bromanyl-4-[2-[4-(1H-indol-2-yl)butyl]-1H-indol-3-yl]-1-methyl-pyrrole-2,5-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22BrN3O2
InChI InChI=1S/C25H22BrN3O2/c1-29-24(30)22(23(26)25(29)31)21-17-10-4-7-12-19(17)28-20(21)13-6-3-9-16-14-15-8-2-5-11-18(15)27-16/h2,4-5,7-8,10-12,14,27-28H,3,6,9,13H2,1H3
InChIKey ZXTNTJHOHDWCOS-UHFFFAOYSA-N
Molecular Weight 476.374 g/mol
SMILES [nH]1c2c(c(c1CCCCc1[nH]c3ccccc3c1)C=1C(N(C)C(C1Br)=O)=O)cccc2
SPLASH splash10-0006-0900000000-a0f80987d5c0fd96a472
Source of Spectrum Y-37-318-5
Synonyms 3-bromo-4-[2-[4-(1H-indol-2-yl)butyl]-1H-indol-3-yl]-1-methyl-3-pyrroline-2,5-quinone 3-bromo-4-[2-[4-(1H-indol-2-yl)butyl]-1H-indol-3-yl]-1-methyl-pyrrole-2,5-dione
Wiley ID 762661