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1H-Pyrrole-2,5-dione, 3,4-di-1H-indol-3-yl-1-(phenylmethyl)-
SpectraBase Compound ID 3mfJUya3HfC
InChI InChI=1S/C27H19N3O2/c31-26-24(20-14-28-22-12-6-4-10-18(20)22)25(21-15-29-23-13-7-5-11-19(21)23)27(32)30(26)16-17-8-2-1-3-9-17/h1-15,28-29H,16H2
InChIKey KCTMKNTUYXUDDV-UHFFFAOYSA-N
Mol Weight 417.47 g/mol
Molecular Formula C27H19N3O2
Exact Mass 417.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lSBVyNGRMj
Name 1H-Pyrrole-2,5-dione, 3,4-di-1H-indol-3-yl-1-(phenylmethyl)-
Alternate Name(s) 1-Benzyl-3,4-bis(1H-indol-3-yl)-3-pyrroline-2,5-quinone 1-Benzyl-3,4-bis(1H-indol-3-yl)pyrrole-2,5-dione 3,4-bis(1H-indol-3-yl)-1-(phenylmethyl)pyrrole-2,5-dione
CAS Registry Number 91026-01-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H19N3O2
InChI InChI=1S/C27H19N3O2/c31-26-24(20-14-28-22-12-6-4-10-18(20)22)25(21-15-29-23-13-7-5-11-19(21)23)27(32)30(26)16-17-8-2-1-3-9-17/h1-15,28-29H,16H2
InChIKey KCTMKNTUYXUDDV-UHFFFAOYSA-N
Molecular Weight 417.468 g/mol
SMILES [nH]1c2c(c(C=3C(N(C(C3c3c[nH]c4c3cccc4)=O)Cc3ccccc3)=O)c1)cccc2
SPLASH splash10-066r-1040900000-d68e3492a04952716e68
Source of Spectrum J-52-1181-8
Wiley ID 1376910