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(3E)-4-{5-Methoxy-1-[(4-methylphenyl)sulfonyl]-1H-indol-3-yl}but-3-en-2-one
SpectraBase Compound ID DSBmChjByk3
InChI InChI=1S/C20H19NO4S/c1-14-4-9-18(10-5-14)26(23,24)21-13-16(7-6-15(2)22)19-12-17(25-3)8-11-20(19)21/h4-13H,1-3H3/b7-6+
InChIKey MILQKZHYTMONAR-VOTSOKGWSA-N
Mol Weight 369.44 g/mol
Molecular Formula C20H19NO4S
Exact Mass 369.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LT4T4i4pFp
Name (3E)-4-{5-Methoxy-1-[(4-methylphenyl)sulfonyl]-1H-indol-3-yl}but-3-en-2-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 369.103479266 u
Formula C20H19NO4S
InChI InChI=1S/C20H19NO4S/c1-14-4-9-18(10-5-14)26(23,24)21-13-16(7-6-15(2)22)19-12-17(25-3)8-11-20(19)21/h4-13H,1-3H3/b7-6+
InChIKey MILQKZHYTMONAR-VOTSOKGWSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901551
Molecular Weight 369.435 g/mol
Quality 251
SMILES C1(OC)=CC2=C(C=C1)N(C=C2\C=C\C(C)=O)S(C1=CC=C(C=C1)C)(=O)=O
SPLASH splash10-07ou-3495000000-6c25f3cc23b276104cc1
Source of Spectrum K1-2019-7716-1r (DOI: 10.1002/ejoc.201901551)
Wiley ID 1892360