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Benzyl But-1-yn-4-yl Sulfide

View entire compound with spectra: 1 MS (GC)

Benzyl But-1-yn-4-yl Sulfide
SpectraBase Compound ID EJiama55HPG
InChI InChI=1S/C11H12S/c1-2-3-9-12-10-11-7-5-4-6-8-11/h1,4-8H,3,9-10H2
InChIKey ZLYSLRAZVSOXMB-UHFFFAOYSA-N
Mol Weight 176.28 g/mol
Molecular Formula C11H12S
Exact Mass 176.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4j8MlrwHq4
Name Benzyl But-1-yn-4-yl Sulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12S
InChI InChI=1S/C11H12S/c1-2-3-9-12-10-11-7-5-4-6-8-11/h1,4-8H,3,9-10H2
InChIKey ZLYSLRAZVSOXMB-UHFFFAOYSA-N
Molecular Weight 176.277 g/mol
SMILES C(#C)CCSCc1ccccc1
SPLASH splash10-00p3-4900000000-2bfb3afb8fc1d685570b
Source of Spectrum J-59-3372-1
Synonyms benzyl 3-butynyl sulfide [(3-Butynylsulfanyl)methyl]benzene But-3-ynylsulfanylmethylbenzene
Wiley ID 1172551