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2-(4-Cholorophenyl)-2-(phenylthio)penta-3,4-dienal
SpectraBase Compound ID 3PansAK7q39
InChI InChI=1S/C17H13ClOS/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 NVIXRPBZBNUWBQ-UHFFFAOYSA-N
Mol Weight 300.8 g/mol
Molecular Formula C17H13ClOS
Exact Mass 300.037564 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HS5EabaTjPV
Name 2-(4-Cholorophenyl)-2-(phenylthio)penta-3,4-dienal
Alternate Name(s) 2-(4-Chlorophenyl)-2-(phenylthio)penta-3,4-dienal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13ClOS
InChI InChI=1S/C17H13ClOS/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 NVIXRPBZBNUWBQ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol070205d
Molecular Weight 300.803 g/mol
SMILES C(C(Sc1ccccc1)(c1ccc(Cl)cc1)C=O)=C=C
SPLASH splash10-004l-0900000000-96ed4d8092009c69856b
Source of Spectrum A1-9-1445/SMS2-1b
Wiley ID 1758010