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2-[2-(Phenylmethyl)-3-pentenyliden-1-yl]-1,3-dithiane
SpectraBase Compound ID B6o9OuKLJ8t
InChI InChI=1S/C16H20S2/c1-3-15(16-17-10-7-11-18-16)13(2)12-14-8-5-4-6-9-14/h4-6,8-9H,2-3,7,10-12H2,1H3
InChIKey PZDCOCQQUZRKMP-UHFFFAOYSA-N
Mol Weight 276.46 g/mol
Molecular Formula C16H20S2
Exact Mass 276.100643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZjFzAKcTIJ
Name 2-[2-(Phenylmethyl)-3-pentenyliden-1-yl]-1,3-dithiane
Alternate Name(s) 2-(2-benzyl-1-ethyl-2-propenylidene)-1,3-dithiane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20S2
InChI InChI=1S/C16H20S2/c1-3-15(16-17-10-7-11-18-16)13(2)12-14-8-5-4-6-9-14/h4-6,8-9H,2-3,7,10-12H2,1H3
InChIKey PZDCOCQQUZRKMP-UHFFFAOYSA-N
Molecular Weight 276.456 g/mol
SMILES C1(=C(C(Cc2ccccc2)=C)CC)SCCCS1
SPLASH splash10-000i-1900000000-6ad082b102269458e3eb
Source of Spectrum QA-39-435-8
Wiley ID 861470