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2-(1-Hydroxy-1-phenylmethyl)-2-(1,3-pentadienyl)-1,3-dithiane
SpectraBase Compound ID 9Wz3Fx9da3e
InChI InChI=1S/C16H20OS2/c1-2-3-7-11-16(18-12-8-13-19-16)15(17)14-9-5-4-6-10-14/h2-7,9-11,15,17H,8,12-13H2,1H3/b3-2+,11-7+
InChIKey XAQAIFBZYUOEMN-LFWRRJNUSA-N
Mol Weight 292.45 g/mol
Molecular Formula C16H20OS2
Exact Mass 292.095558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfkV04A9Jmx
Name 2-(1-Hydroxy-1-phenylmethyl)-2-(1,3-pentadienyl)-1,3-dithiane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20OS2
InChI InChI=1S/C16H20OS2/c1-2-3-7-11-16(18-12-8-13-19-16)15(17)14-9-5-4-6-10-14/h2-7,9-11,15,17H,8,12-13H2,1H3/b3-2+,11-7+
InChIKey XAQAIFBZYUOEMN-LFWRRJNUSA-N
Molecular Weight 292.455 g/mol
SMILES OC(C1(SCCCS1)\C=C\C=C\C)c1ccccc1
SPLASH splash10-0550-2900000000-d038a200e3b48c520c4d
Source of Spectrum QA-39-436-13
Synonyms {2-[(1E,3E)-1,3-pentadienyl]-1,3-dithian-2-yl}(phenyl)methanol
Wiley ID 861462