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2-Benzylidene-1,3-dithiane

View entire compound with spectra: 1 FTIR, and 3 MS (GC)

2-Benzylidene-1,3-dithiane
SpectraBase Compound ID EZHzA3ZB0S4
InChI InChI=1S/C11H12S2/c1-2-5-10(6-3-1)9-11-12-7-4-8-13-11/h1-3,5-6,9H,4,7-8H2
InChIKey QLYMFSCHJDDTQS-UHFFFAOYSA-N
Mol Weight 208.34 g/mol
Molecular Formula C11H12S2
Exact Mass 208.038043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 18an6t5KdM4
Name 2-Benzylidene-1,3-dithiane
CAS Registry Number 17590-58-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12S2
InChI InChI=1S/C11H12S2/c1-2-5-10(6-3-1)9-11-12-7-4-8-13-11/h1-3,5-6,9H,4,7-8H2
InChIKey QLYMFSCHJDDTQS-UHFFFAOYSA-N
Molecular Weight 208.337 g/mol
SMILES C1(SCCCS1)=Cc1ccccc1
SPLASH splash10-0a59-3970000000-1d31bd0f220f30ee2362
Synonyms 2-(Phenylmethylene)-1,3-dithiane 2-(Phenylmethylidene)-1,3-dithiane 2-Benzal-1,3-dithiane
Wiley ID 1478483