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(E)-1-(Benzenesulfonyl)-2-butyl-4-phenylbut-1-en-3-yne

View entire compound with spectra: 1 MS (GC)

(E)-1-(Benzenesulfonyl)-2-butyl-4-phenylbut-1-en-3-yne
SpectraBase Compound ID ED5fuFEqeez
InChI InChI=1S/C20H20O2S/c1-2-3-10-19(16-15-18-11-6-4-7-12-18)17-23(21,22)20-13-8-5-9-14-20/h4-9,11-14,17H,2-3,10H2,1H3/b19-17+
InChIKey QDKBQIMTLUNJOD-HTXNQAPBSA-N
Mol Weight 324.44 g/mol
Molecular Formula C20H20O2S
Exact Mass 324.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gm8qketPy1L
Name (E)-1-(Benzenesulfonyl)-2-butyl-4-phenylbut-1-en-3-yne
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O2S
InChI InChI=1S/C20H20O2S/c1-2-3-10-19(16-15-18-11-6-4-7-12-18)17-23(21,22)20-13-8-5-9-14-20/h4-9,11-14,17H,2-3,10H2,1H3/b19-17+
InChIKey QDKBQIMTLUNJOD-HTXNQAPBSA-N
Molecular Weight 324.438 g/mol
SMILES C(\C(=C\S(=O)(=O)c1ccccc1)CCCC)#Cc1ccccc1
SPLASH splash10-004l-9431000000-ea424379f5eee9603c74
Source of Spectrum U1-2012-834-3b
Synonyms [(3E)-3-(benzenesulfonylmethylidene)hept-1-ynyl]benzene [(3E)-3-(benzenesulfonylmethylene)hept-1-ynyl]benzene [(3E)-3-(phenylsulfonylmethylidene)hept-1-ynyl]benzene
Wiley ID 1705467