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1-Benzyl-2-(4-nitrophenyl)-1H-indol-3-yl benzoate
SpectraBase Compound ID 7qCwrdm1PE3
InChI InChI=1S/C28H20N2O4/c31-28(22-11-5-2-6-12-22)34-27-24-13-7-8-14-25(24)29(19-20-9-3-1-4-10-20)26(27)21-15-17-23(18-16-21)30(32)33/h1-18H,19H2
InChIKey AFRUXECQHKNTJI-UHFFFAOYSA-N
Mol Weight 448.48 g/mol
Molecular Formula C28H20N2O4
Exact Mass 448.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8EnRn8BclOX
Name 1-Benzyl-2-(4-nitrophenyl)-1H-indol-3-yl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H20N2O4
InChI InChI=1S/C28H20N2O4/c31-28(22-11-5-2-6-12-22)34-27-24-13-7-8-14-25(24)29(19-20-9-3-1-4-10-20)26(27)21-15-17-23(18-16-21)30(32)33/h1-18H,19H2
InChIKey AFRUXECQHKNTJI-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol201062r
Molecular Weight 448.478 g/mol
SMILES c1cc2c(c([n](Cc3ccccc3)c2cc1)-c1ccc(cc1)[N+](=O)[O-])OC(c1ccccc1)=O
SPLASH splash10-054p-9807800000-795ba6f3b712a1f6d778
Source of Spectrum A1-13-2970/SMS28-3d
Synonyms Benzoic acid [2-(4-nitrophenyl)-1-(phenylmethyl)-3-indolyl] ester [1-benzyl-2-(4-nitrophenyl)indol-3-yl] benzoate [2-(4-nitrophenyl)-1-(phenylmethyl)indol-3-yl] benzoate
Wiley ID 1753275