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(E)-1-(1-besylindol-3-yl)but-2-en-1-one
SpectraBase Compound ID DIJiAfxhNcZ
InChI InChI=1S/C18H15NO3S/c1-2-8-18(20)16-13-19(17-12-7-6-11-15(16)17)23(21,22)14-9-4-3-5-10-14/h2-13H,1H3/b8-2+
InChIKey SIQYBFBPUIVOTJ-KRXBUXKQSA-N
Mol Weight 325.38 g/mol
Molecular Formula C18H15NO3S
Exact Mass 325.077265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 93L9ApRpD8P
Name (E)-1-(1-besylindol-3-yl)but-2-en-1-one
CAS Registry Number 114906-89-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO3S
InChI InChI=1S/C18H15NO3S/c1-2-8-18(20)16-13-19(17-12-7-6-11-15(16)17)23(21,22)14-9-4-3-5-10-14/h2-13H,1H3/b8-2+
InChIKey SIQYBFBPUIVOTJ-KRXBUXKQSA-N
Molecular Weight 325.382 g/mol
SMILES c1(S([n]2cc(C(\C=C\C)=O)c3c2cccc3)(=O)=O)ccccc1
SPLASH splash10-004i-9703000000-e5680c8cb365b33a3f5a
Source of Spectrum J-53-3174-11
Synonyms (E)-1-[1-(benzenesulfonyl)-3-indolyl]-2-buten-1-one (E)-1-[1-(benzenesulfonyl)indol-3-yl]but-2-en-1-one (E)-1-[1-(phenylsulfonyl)indol-3-yl]but-2-en-1-one
Wiley ID 1323968