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(E)-4-Phenylthio-but-3-en-2-one

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(E)-4-Phenylthio-but-3-en-2-one
SpectraBase Compound ID BZyw0ZCAjSS
InChI InChI=1S/C10H10OS/c1-9(11)7-8-12-10-5-3-2-4-6-10/h2-8H,1H3/b8-7+
InChIKey IUDATFOKAOFQMH-BQYQJAHWSA-N
Mol Weight 178.25 g/mol
Molecular Formula C10H10OS
Exact Mass 178.045236 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ACucFhCQYU
Name (E)-4-Phenylthio-but-3-en-2-one
CAS Registry Number 33944-98-8
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C10H10OS
InChI InChI=1S/C10H10OS/c1-9(11)7-8-12-10-5-3-2-4-6-10/h2-8H,1H3/b8-7+
InChIKey IUDATFOKAOFQMH-BQYQJAHWSA-N
Instrument Name Varian FT-80
Literature Reference C. Najera, B. Baldo, M.Yus, J. Chem. Soc. Perkin I 1029 (1988).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3