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Ethyl 7-chloro-6-cyano-5-fluoro-2-phenyl-1H-indole-4-carboxylate
SpectraBase Compound ID B9A0RJ8cjWv
InChI InChI=1S/C18H12ClFN2O2/c1-2-24-18(23)14-11-8-13(10-6-4-3-5-7-10)22-17(11)15(19)12(9-21)16(14)20/h3-8,22H,2H2,1H3
InChIKey MJVMNJFXJMJZQU-UHFFFAOYSA-N
Mol Weight 342.76 g/mol
Molecular Formula C18H12ClFN2O2
Exact Mass 342.057133 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2Uzb2o4jQX
Name Ethyl 7-chloro-6-cyano-5-fluoro-2-phenyl-1H-indole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12ClFN2O2
InChI InChI=1S/C18H12ClFN2O2/c1-2-24-18(23)14-11-8-13(10-6-4-3-5-7-10)22-17(11)15(19)12(9-21)16(14)20/h3-8,22H,2H2,1H3
InChIKey MJVMNJFXJMJZQU-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol7025872
Molecular Weight 342.757 g/mol
SMILES [nH]1c(cc2c(c(c(c(c12)Cl)C#N)F)C(=O)OCC)-c1ccccc1
SPLASH splash10-0006-0069000000-af82e9273ab88bb0b893
Source of Spectrum A1-10-113/SM19-1h
Wiley ID 1758920