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(3E)-4-[2-(3,4-Dimethoxyphenyl)-6-methyl-1H-indol-3-yl]but-3-en-2-one
SpectraBase Compound ID uyIjRy5Ifi
InChI InChI=1S/C21H21NO3/c1-13-5-8-16-17(9-6-14(2)23)21(22-18(16)11-13)15-7-10-19(24-3)20(12-15)25-4/h5-12,22H,1-4H3/b9-6+
InChIKey KCKGFDWPCWMCRP-RMKNXTFCSA-N
Mol Weight 335.4 g/mol
Molecular Formula C21H21NO3
Exact Mass 335.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FT7tsBsLIc2
Name (3E)-4-[2-(3,4-Dimethoxyphenyl)-6-methyl-1H-indol-3-yl]but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO3
InChI InChI=1S/C21H21NO3/c1-13-5-8-16-17(9-6-14(2)23)21(22-18(16)11-13)15-7-10-19(24-3)20(12-15)25-4/h5-12,22H,1-4H3/b9-6+
InChIKey KCKGFDWPCWMCRP-RMKNXTFCSA-N
Molecular Weight 335.403 g/mol
SMILES [nH]1c2cc(ccc2c(c1-c1cc(OC)c(cc1)OC)\C=C\C(=O)C)C
SPLASH splash10-03xu-2092000000-23bc5894c4a4be191823
Source of Spectrum U1-2010-924-3i
Synonyms (E)-4-[2-(3,4-dimethoxyphenyl)-6-methyl-1H-indol-3-yl]-3-buten-2-one
Wiley ID 1663429