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2-(4-Bromophenyl)-2-(phenylthio)penta-3,4-dienal
SpectraBase Compound ID GXZ8la1aBN1
InChI InChI=1S/C17H13BrOS/c1-2-12-17(13-19,14-8-10-15(18)11-9-14)20-16-6-4-3-5-7-16/h3-13H,1H2
InChIKey PZRTWVGSWQICSP-UHFFFAOYSA-N
Mol Weight 345.25 g/mol
Molecular Formula C17H13BrOS
Exact Mass 343.987049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3AlxfmUNCas
Name 2-(4-Bromophenyl)-2-(phenylthio)penta-3,4-dienal
Alternate Name(s) 2-(4-bromophenyl)-2-phenylsulfanylpenta-3,4-dienal 2-(4-bromophenyl)-2-phenylsulfanyl-penta-3,4-dienal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13BrOS
InChI InChI=1S/C17H13BrOS/c1-2-12-17(13-19,14-8-10-15(18)11-9-14)20-16-6-4-3-5-7-16/h3-13H,1H2
InChIKey PZRTWVGSWQICSP-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol070205d
Molecular Weight 345.254 g/mol
SMILES C(=C=C)C(C=O)(c1ccc(cc1)Br)Sc1ccccc1
SPLASH splash10-0570-0931000000-d11e75388cda0acba6db
Source of Spectrum A1-9-1445/SMS3-1f
Wiley ID 1758014