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2-(4-Fluorophenyl)methyl-1,3-dithiane
SpectraBase Compound ID HcG9A2RQ1Fa
InChI InChI=1S/C11H13FS2/c12-10-4-2-9(3-5-10)8-11-13-6-1-7-14-11/h2-5,11H,1,6-8H2
InChIKey YEQKOMNALWGRAQ-UHFFFAOYSA-N
Mol Weight 228.34 g/mol
Molecular Formula C11H13FS2
Exact Mass 228.044271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9LY0u50jzU
Name 2-(4-Fluorophenyl)methyl-1,3-dithiane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13FS2
InChI InChI=1S/C11H13FS2/c12-10-4-2-9(3-5-10)8-11-13-6-1-7-14-11/h2-5,11H,1,6-8H2
InChIKey YEQKOMNALWGRAQ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.joc.5b00547
Molecular Weight 228.343 g/mol
SMILES c1c(ccc(c1)CC1SCCCS1)F
SPLASH splash10-014i-0900000000-3ade4614fb982c8ecb08
Source of Spectrum J-80-4129-28
Synonyms 2-(4-fluorobenzyl)-1,3-dithiane 2-[(4-fluorophenyl)methyl]-1,3-dithiane
Wiley ID 1761300