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3-(1-(1,3-Dithian-2-ylidene)ethyl)cyclopentan-1-one
SpectraBase Compound ID CXL8oUJDn3Q
InChI InChI=1S/C11H16OS2/c1-8(9-3-4-10(12)7-9)11-13-5-2-6-14-11/h9H,2-7H2,1H3
InChIKey WQJQUKJBHBQXMD-UHFFFAOYSA-N
Mol Weight 228.37 g/mol
Molecular Formula C11H16OS2
Exact Mass 228.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BypdjqXd4cv
Name 3-(1-(1,3-Dithian-2-ylidene)ethyl)cyclopentan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16OS2
InChI InChI=1S/C11H16OS2/c1-8(9-3-4-10(12)7-9)11-13-5-2-6-14-11/h9H,2-7H2,1H3
InChIKey WQJQUKJBHBQXMD-UHFFFAOYSA-N
Instrument Name Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.14.37
Molecular Weight 228.368 g/mol
Reported Formula C11H16OS2
SMILES CC(=C1SCCCS1)C1CCC(C1)=O
SPLASH splash10-0059-9650000000-5f7b539c9144288af1a6
Source of Spectrum BJO-14-SM23-10c
Thin-Layer Chromatography Rf = 0.42 (cyclohexane/ethyl acetate, 4:1)
Wiley ID 1845776