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3-(1-(1,3-Dithiolan-2-ylidene)propyl)cyclopentan-1-one
SpectraBase Compound ID 9Jl0yvSE7ir
InChI InChI=1S/C11H16OS2/c1-2-10(11-13-5-6-14-11)8-3-4-9(12)7-8/h8H,2-7H2,1H3
InChIKey BTUSJJHTMUJDHS-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 HW5XnniHbvI
Name 3-(1-(1,3-Dithiolan-2-ylidene)propyl)cyclopentan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16OS2
InChI InChI=1S/C11H16OS2/c1-2-10(11-13-5-6-14-11)8-3-4-9(12)7-8/h8H,2-7H2,1H3
InChIKey BTUSJJHTMUJDHS-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 C(C(=C1SCCS1)C1CC(CC1)=O)C
SPLASH splash10-001r-9010000000-cca8890e7808ee48713e
Source of Spectrum BJO-14-SM25-9e
Thin-Layer Chromatography Rf = 0.63 (cyclohexane/ethyl acetate, 2:1)
Wiley ID 1845818