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(3E)-4-[6-Chloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]but-3-en-2-one
SpectraBase Compound ID JGMbYHW87Y9
InChI InChI=1S/C20H18ClNO3/c1-12(23)4-7-16-15-8-6-14(21)11-17(15)22-20(16)13-5-9-18(24-2)19(10-13)25-3/h4-11,22H,1-3H3/b7-4+
InChIKey TXRYQSFQBDMRAF-QPJJXVBHSA-N
Mol Weight 355.82 g/mol
Molecular Formula C20H18ClNO3
Exact Mass 355.097521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4oKNYpTp7VV
Name (3E)-4-[6-Chloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18ClNO3
InChI InChI=1S/C20H18ClNO3/c1-12(23)4-7-16-15-8-6-14(21)11-17(15)22-20(16)13-5-9-18(24-2)19(10-13)25-3/h4-11,22H,1-3H3/b7-4+
InChIKey TXRYQSFQBDMRAF-QPJJXVBHSA-N
Molecular Weight 355.821 g/mol
SMILES [nH]1c2cc(ccc2c(c1-c1cc(OC)c(cc1)OC)\C=C\C(=O)C)Cl
SPLASH splash10-0006-9000000000-f6c4433a52bfda17de98
Source of Spectrum U1-2010-924-3l
Synonyms (E)-4-[6-chloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]-3-buten-2-one (E)-4-[6-chloranyl-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]but-3-en-2-one
Wiley ID 1663426