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4,6-Dimethoxy-3-methyl-2-trichloroacetylindole
SpectraBase Compound ID K3gVrn8zYzd
InChI InChI=1S/C13H12Cl3NO3/c1-6-10-8(4-7(19-2)5-9(10)20-3)17-11(6)12(18)13(14,15)16/h4-5,17H,1-3H3
InChIKey MRUIRVQLWDIPDI-UHFFFAOYSA-N
Mol Weight 336.6 g/mol
Molecular Formula C13H12Cl3NO3
Exact Mass 334.988276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IXKZpcCaHm
Name 4,6-Dimethoxy-3-methyl-2-trichloroacetylindole
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.988276347 u
Formula C13H12Cl3NO3
InChI InChI=1S/C13H12Cl3NO3/c1-6-10-8(4-7(19-2)5-9(10)20-3)17-11(6)12(18)13(14,15)16/h4-5,17H,1-3H3
InChIKey MRUIRVQLWDIPDI-UHFFFAOYSA-N
Instrument Name VG Quattro
Ionization Type EI positive ion
Literature Reference DOI 10.24820/ark.5550190.p011.637
Molecular Weight 336.602 g/mol
SMILES N1C(=C(C2=C1C=C(C=C2OC)OC)C)C(C(Cl)(Cl)Cl)=O
SPLASH splash10-00di-0090000000-5f2d27f7da138e64f8d4
Source of Spectrum ARK-2022-17-12 (DOI: 10.24820/ark.5550190.p011.637)
Wiley ID 1898072