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Benzyl 2-(4-Chlorobenzyl)-5-hydroxy-1H-benzo[g]indole-3-carboxylate
SpectraBase Compound ID DA3AW0SUneY
InChI InChI=1S/C27H20ClNO3/c28-19-12-10-17(11-13-19)14-23-25(27(31)32-16-18-6-2-1-3-7-18)22-15-24(30)20-8-4-5-9-21(20)26(22)29-23/h1-13,15,29-30H,14,16H2
InChIKey MGYJZFAHYAJOGR-UHFFFAOYSA-N
Mol Weight 441.91 g/mol
Molecular Formula C27H20ClNO3
Exact Mass 441.113171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BKLnXOOA90L
Name Benzyl 2-(4-Chlorobenzyl)-5-hydroxy-1H-benzo[g]indole-3-carboxylate
Appearance White powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H20ClNO3
InChI InChI=1S/C27H20ClNO3/c28-19-12-10-17(11-13-19)14-23-25(27(31)32-16-18-6-2-1-3-7-18)22-15-24(30)20-8-4-5-9-21(20)26(22)29-23/h1-13,15,29-30H,14,16H2
InChIKey MGYJZFAHYAJOGR-UHFFFAOYSA-N
Instrument Name Finnigan MAT TSQ 70
Ionization Type EI
Literature Reference DOI 10.1021/jm900212y
Molecular Weight 441.914 g/mol
SMILES [nH]1c2c(cc(c3c2cccc3)O)c(C(OCc2ccccc2)=O)c1Cc1ccc(cc1)Cl
SPLASH splash10-0udl-3009200000-07aa1304378337e321d8
Source of Spectrum AF-52-SM19-11r
Wiley ID 1873566