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5-(1,3-Dithian-2-ylidene)-5-phenylpentan-2-one
SpectraBase Compound ID A67AEVkap0I
InChI InChI=1S/C15H18OS2/c1-12(16)8-9-14(13-6-3-2-4-7-13)15-17-10-5-11-18-15/h2-4,6-7H,5,8-11H2,1H3
InChIKey HLVFYRZSXYKKMF-UHFFFAOYSA-N
Mol Weight 278.43 g/mol
Molecular Formula C15H18OS2
Exact Mass 278.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8kysjOIC950
Name 5-(1,3-Dithian-2-ylidene)-5-phenylpentan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18OS2
InChI InChI=1S/C15H18OS2/c1-12(16)8-9-14(13-6-3-2-4-7-13)15-17-10-5-11-18-15/h2-4,6-7H,5,8-11H2,1H3
InChIKey HLVFYRZSXYKKMF-UHFFFAOYSA-N
Instrument Name Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.14.37
Molecular Weight 278.428 g/mol
Reported Formula C15H18OS2
SMILES c1cc(ccc1)C(=C1SCCCS1)CCC(C)=O
SPLASH splash10-00fr-0390000000-9a3b702aece48213e5d5
Source of Spectrum BJO-14-SM6-5a
Thin-Layer Chromatography Rf = 0.63 (cyclohexane/ethyl acetate, 2:1)
Wiley ID 1845804