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Ethyl 2-(3-Chlorobenzyl)-5-hydroxy-6-phenyl-1H-indole-3-carboxylate
SpectraBase Compound ID COZSu1TP8mP
InChI InChI=1S/C24H20ClNO3/c1-2-29-24(28)23-19-14-22(27)18(16-8-4-3-5-9-16)13-20(19)26-21(23)12-15-7-6-10-17(25)11-15/h3-11,13-14,26-27H,2,12H2,1H3
InChIKey QGNJOPRXYQWPCK-UHFFFAOYSA-N
Mol Weight 405.88 g/mol
Molecular Formula C24H20ClNO3
Exact Mass 405.113171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29ZKj35WmKo
Name Ethyl 2-(3-Chlorobenzyl)-5-hydroxy-6-phenyl-1H-indole-3-carboxylate
Appearance White crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20ClNO3
InChI InChI=1S/C24H20ClNO3/c1-2-29-24(28)23-19-14-22(27)18(16-8-4-3-5-9-16)13-20(19)26-21(23)12-15-7-6-10-17(25)11-15/h3-11,13-14,26-27H,2,12H2,1H3
InChIKey QGNJOPRXYQWPCK-UHFFFAOYSA-N
Instrument Name Finnigan MAT TSQ 70
Ionization Type EI
Literature Reference DOI 10.1021/jm900212y
Molecular Weight 405.881 g/mol
SMILES [nH]1c2c(cc(c(c2)-c2ccccc2)O)c(C(OCC)=O)c1Cc1cc(ccc1)Cl
SPLASH splash10-0a6r-0019800000-01777fbc3c5a44bbb51e
Source of Spectrum AF-52-SM20-21
Wiley ID 1873569