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3-(benzenesulfonyl)-4-ethoxy-2-butanone
SpectraBase Compound ID 70JIEcFASkA
InChI InChI=1S/C12H16O4S/c1-3-16-9-12(10(2)13)17(14,15)11-7-5-4-6-8-11/h4-8,12H,3,9H2,1-2H3
InChIKey MLCYBKHWCMYDTL-UHFFFAOYSA-N
Mol Weight 256.32 g/mol
Molecular Formula C12H16O4S
Exact Mass 256.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID MpmVFj65DG
Name 3-(benzenesulfonyl)-4-ethoxy-2-butanone
CAS Registry Number 133834-24-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4S
InChI InChI=1S/C12H16O4S/c1-3-16-9-12(10(2)13)17(14,15)11-7-5-4-6-8-11/h4-8,12H,3,9H2,1-2H3
InChIKey MLCYBKHWCMYDTL-UHFFFAOYSA-N
Molecular Weight 256.316 g/mol
SMILES C(S(=O)(=O)c1ccccc1)(C(=O)C)COCC
SPLASH splash10-00or-3900000000-bb2bac02bd0a0ceda753
Source of Spectrum J-56-4106-6
Synonyms 3-(benzenesulfonyl)-4-ethoxy-butan-2-one 3-besyl-4-ethoxy-butan-2-one 4-Ethoxy-3-(phenylsulfonyl)butan-2-one
Wiley ID 1259399