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6-(1,3-Dithiolan-2-ylidene)-6-phenylhexan-3-one
SpectraBase Compound ID 68HcofNyZCz
InChI InChI=1S/C15H18OS2/c1-2-13(16)8-9-14(15-17-10-11-18-15)12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3
InChIKey MQHLDGLJNBYOQQ-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 F7zIndksjtQ
Name 6-(1,3-Dithiolan-2-ylidene)-6-phenylhexan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18OS2
InChI InChI=1S/C15H18OS2/c1-2-13(16)8-9-14(15-17-10-11-18-15)12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3
InChIKey MQHLDGLJNBYOQQ-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(=C1SCCS1)CCC(CC)=O
SPLASH splash10-0a7i-3390000000-5574669ccf8320eb452d
Source of Spectrum BJO-14-SM6-4b
Thin-Layer Chromatography Rf = 0.53 (cyclohexane/ethyl acetate, 4:1)
Wiley ID 1845786