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Ethyl (E)-3-[N-(p-Tolylsulfonyl)indol-7'-yl]-crotonate
SpectraBase Compound ID 2tgkUGoLvK6
InChI InChI=1S/C21H21NO4S/c1-4-26-20(23)14-16(3)19-7-5-6-17-12-13-22(21(17)19)27(24,25)18-10-8-15(2)9-11-18/h5-14H,4H2,1-3H3/b16-14-
InChIKey ATNABJXZMCVFRM-PEZBUJJGSA-N
Mol Weight 383.46 g/mol
Molecular Formula C21H21NO4S
Exact Mass 383.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QxJQuQ9mYt
Name Ethyl (E)-3-[N-(p-Tolylsulfonyl)indol-7'-yl]-crotonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO4S
InChI InChI=1S/C21H21NO4S/c1-4-26-20(23)14-16(3)19-7-5-6-17-12-13-22(21(17)19)27(24,25)18-10-8-15(2)9-11-18/h5-14H,4H2,1-3H3/b16-14-
InChIKey ATNABJXZMCVFRM-PEZBUJJGSA-N
Molecular Weight 383.462 g/mol
SMILES c12[n](S(c3ccc(cc3)C)(=O)=O)ccc2cccc1\C(=C/C(=O)OCC)C
SPLASH splash10-001l-9507000000-3f21b0e184915f186f56
Source of Spectrum F5-2-1453-4c
Synonyms (Z)-ethyl 3-(1-tosyl-1H-indol-7-yl)but-2-enoate
Wiley ID 1731842