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Phenylsulfonyl-acetone

View entire compound with spectra: 3 NMR, 2 FTIR, 1 Raman, and 3 MS (GC)

Phenylsulfonyl-acetone
SpectraBase Compound ID FiWa7v9FlCe
InChI InChI=1S/C9H10O3S/c1-8(10)7-13(11,12)9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey YBLGSNMIIPIRFC-UHFFFAOYSA-N
Mol Weight 198.24 g/mol
Molecular Formula C9H10O3S
Exact Mass 198.035065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 52oIyBgasrz
Name Phenylsulfonyl-acetone
CAS Registry Number 5000-44-2
Comments EXTERNAL TMS IN DMSO AS STANDARD
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C9H10O3S
InChI InChI=1S/C9H10O3S/c1-8(10)7-13(11,12)9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey YBLGSNMIIPIRFC-UHFFFAOYSA-N
Literature Reference E. Barchiesi, S. Bradamante, R. Ferraccioli, J. Chem. Soc. Perkin II 375 (1990).
NMR Standard see comment
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CH3OH