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Ethyl 2-(4-Bromobenzyl)-5-hydroxy-1H-benzo[g]indole-3-carboxylate
SpectraBase Compound ID 2UMauz4o4Tp
InChI InChI=1S/C22H18BrNO3/c1-2-27-22(26)20-17-12-19(25)15-5-3-4-6-16(15)21(17)24-18(20)11-13-7-9-14(23)10-8-13/h3-10,12,24-25H,2,11H2,1H3
InChIKey UUIVFTPUMYBUJS-UHFFFAOYSA-N
Mol Weight 424.29 g/mol
Molecular Formula C22H18BrNO3
Exact Mass 423.047006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DmFygrNmOO
Name Ethyl 2-(4-Bromobenzyl)-5-hydroxy-1H-benzo[g]indole-3-carboxylate
Appearance Brown powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18BrNO3
InChI InChI=1S/C22H18BrNO3/c1-2-27-22(26)20-17-12-19(25)15-5-3-4-6-16(15)21(17)24-18(20)11-13-7-9-14(23)10-8-13/h3-10,12,24-25H,2,11H2,1H3
InChIKey UUIVFTPUMYBUJS-UHFFFAOYSA-N
Instrument Name Finnigan MAT TSQ 70
Ionization Type EI
Literature Reference DOI 10.1021/jm900212y
Molecular Weight 424.294 g/mol
SMILES [nH]1c2c(cc(c3c2cccc3)O)c(C(OCC)=O)c1Cc1ccc(cc1)Br
SPLASH splash10-00fv-0048900000-7c67995161594befe03b
Source of Spectrum AF-52-SM17-11g
Wiley ID 1873556