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2-[(E)-3-phenylprop-2-enyl]-1,3-dithiane
SpectraBase Compound ID G1Oo0LWISCr
InChI InChI=1S/C13H16S2/c1-2-6-12(7-3-1)8-4-9-13-14-10-5-11-15-13/h1-4,6-8,13H,5,9-11H2/b8-4+
InChIKey OCYZWDSMVLOAPE-XBXARRHUSA-N
Mol Weight 236.39 g/mol
Molecular Formula C13H16S2
Exact Mass 236.069343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2G1UQyUzzMK
Name 2-[(E)-3-phenylprop-2-enyl]-1,3-dithiane
Alternate Name(s) 2-[(E)-cinnamyl]-1,3-dithiane
CAS Registry Number 64899-13-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16S2
InChI InChI=1S/C13H16S2/c1-2-6-12(7-3-1)8-4-9-13-14-10-5-11-15-13/h1-4,6-8,13H,5,9-11H2/b8-4+
InChIKey OCYZWDSMVLOAPE-XBXARRHUSA-N
Molecular Weight 236.391 g/mol
SMILES C1(SCCCS1)C\C=C\c1ccccc1
SPLASH splash10-006t-1930000000-cf2ecfeba7a81fe6864a
Source of Spectrum O-12-158-0
Wiley ID 1238152