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4-(1,3-Dithiolan-2-ylidene)-1,3-diphenylhexan-1-one
SpectraBase Compound ID IhuZeh2BxDL
InChI InChI=1S/C21H22OS2/c1-2-18(21-23-13-14-24-21)19(16-9-5-3-6-10-16)15-20(22)17-11-7-4-8-12-17/h3-12,19H,2,13-15H2,1H3
InChIKey FFNUZHPVLBYLFF-UHFFFAOYSA-N
Mol Weight 354.53 g/mol
Molecular Formula C21H22OS2
Exact Mass 354.111208 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4oYcopS8Lw
Name 4-(1,3-Dithiolan-2-ylidene)-1,3-diphenylhexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22OS2
InChI InChI=1S/C21H22OS2/c1-2-18(21-23-13-14-24-21)19(16-9-5-3-6-10-16)15-20(22)17-11-7-4-8-12-17/h3-12,19H,2,13-15H2,1H3
InChIKey FFNUZHPVLBYLFF-UHFFFAOYSA-N
Instrument Name Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.14.37
Molecular Weight 354.526 g/mol
Reported Formula C21H22OS2,
SMILES C(C(=C1SCCS1)C(CC(c1ccccc1)=O)c1ccccc1)C
SPLASH splash10-01si-9303000000-af923441e85ecc720c9d
Source of Spectrum BJO-14-SM19-4q
Thin-Layer Chromatography Rf = 0.73 (cyclohexane/ethyl acetate, 2:1)
Wiley ID 1845801