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2-(4-(4-bromobenzyl)-5-oxotetrahydrofuran-2-yl)-6-methyl-N-(quinolin-8-yl)benzamide
SpectraBase Compound ID LmkkqFwrSLE
InChI InChI=1S/C28H23BrN2O3/c1-17-5-2-8-22(24-16-20(28(33)34-24)15-18-10-12-21(29)13-11-18)25(17)27(32)31-23-9-3-6-19-7-4-14-30-26(19)23/h2-14,20,24H,15-16H2,1H3,(H,31,32)
InChIKey BYOLVDAOVLVYKB-UHFFFAOYSA-N
Mol Weight 515.41 g/mol
Molecular Formula C28H23BrN2O3
Exact Mass 514.089206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4No6ivvSLtE
Name 2-(4-(4-bromobenzyl)-5-oxotetrahydrofuran-2-yl)-6-methyl-N-(quinolin-8-yl)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H23BrN2O3
InChI InChI=1S/C28H23BrN2O3/c1-17-5-2-8-22(24-16-20(28(33)34-24)15-18-10-12-21(29)13-11-18)25(17)27(32)31-23-9-3-6-19-7-4-14-30-26(19)23/h2-14,20,24H,15-16H2,1H3,(H,31,32)
InChIKey BYOLVDAOVLVYKB-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5SC03110A
Molecular Weight 515.407 g/mol
SMILES N(C(c1c(cccc1C)C1OC(C(C1)Cc1ccc(cc1)Br)=O)=O)c1cccc2cccnc12
SPLASH splash10-00dl-0901020000-e375297baae18d358374
Source of Spectrum CSS-7-240/SM10-3af
Wiley ID 1801113