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1-(1-besylpyrrol-3-yl)-3-(1,3-dioxan-2-yl)butan-1-one
SpectraBase Compound ID v5eMrfrroJ
InChI InChI=1S/C18H21NO5S/c1-14(18-23-10-5-11-24-18)12-17(20)15-8-9-19(13-15)25(21,22)16-6-3-2-4-7-16/h2-4,6-9,13-14,18H,5,10-12H2,1H3
InChIKey UDDXVKFOAXKPMB-UHFFFAOYSA-N
Mol Weight 363.43 g/mol
Molecular Formula C18H21NO5S
Exact Mass 363.114044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CfWcQaDVA
Name 1-(1-besylpyrrol-3-yl)-3-(1,3-dioxan-2-yl)butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO5S
InChI InChI=1S/C18H21NO5S/c1-14(18-23-10-5-11-24-18)12-17(20)15-8-9-19(13-15)25(21,22)16-6-3-2-4-7-16/h2-4,6-9,13-14,18H,5,10-12H2,1H3
InChIKey UDDXVKFOAXKPMB-UHFFFAOYSA-N
Molecular Weight 363.428 g/mol
SMILES c1[n](ccc1C(CC(C)C1OCCCO1)=O)S(=O)(=O)c1ccccc1
SPLASH splash10-03dr-9710000000-6034ac8c2985fd6650d5
Source of Spectrum E1-43-43-16
Synonyms 1-[1-(benzenesulfonyl)-3-pyrrolyl]-3-(1,3-dioxan-2-yl)-1-butanone 1-[1-(benzenesulfonyl)pyrrol-3-yl]-3-(1,3-dioxan-2-yl)butan-1-one 3-(1,3-dioxan-2-yl)-1-[1-(phenylsulfonyl)pyrrol-3-yl]butan-1-one
Wiley ID 1552872