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1-((4-Chlorobenzyl)thio)propan-2-one
SpectraBase Compound ID EuRSNnY0Oen
InChI InChI=1S/C10H11ClOS/c1-8(12)6-13-7-9-2-4-10(11)5-3-9/h2-5H,6-7H2,1H3
InChIKey JNFWNBVDFWSOQJ-UHFFFAOYSA-N
Mol Weight 214.71 g/mol
Molecular Formula C10H11ClOS
Exact Mass 214.021914 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ej0TsbHC0Zm
Name 1-((4-Chlorobenzyl)thio)propan-2-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11ClOS
InChI InChI=1S/C10H11ClOS/c1-8(12)6-13-7-9-2-4-10(11)5-3-9/h2-5H,6-7H2,1H3
InChIKey JNFWNBVDFWSOQJ-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MSQP2010
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.17.24
Molecular Weight 214.710 g/mol
Reported Formula C10H11ClOS
SMILES CC(=O)CSCc1ccc(cc1)Cl
SPLASH splash10-056r-0900000000-0bc530eb3bf868c9c80f
Source of Spectrum BJO-17-SM7-4c
Wiley ID 1858442