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1-(Phenylthio)-4-methoxybutan-2-one

View entire compound with spectra: 2 MS (GC)

1-(Phenylthio)-4-methoxybutan-2-one
SpectraBase Compound ID FUnP8NodxKg
InChI InChI=1S/C11H14O2S/c1-13-8-7-10(12)9-14-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3
InChIKey TYTDLNJFHCQOIX-UHFFFAOYSA-N
Mol Weight 210.29 g/mol
Molecular Formula C11H14O2S
Exact Mass 210.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KxxxhRLn3ME
Name 1-(Phenylthio)-4-methoxybutan-2-one
CAS Registry Number 35737-56-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2S
InChI InChI=1S/C11H14O2S/c1-13-8-7-10(12)9-14-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3
InChIKey TYTDLNJFHCQOIX-UHFFFAOYSA-N
Molecular Weight 210.291 g/mol
SMILES C(Sc1ccccc1)C(=O)CCOC
SPLASH splash10-00dj-9700000000-88054567f7be5916c09a
Source of Spectrum J-53-2740-2
Synonyms 4-Methoxy-1-(phenylthio)-2-butanone 4-Methoxy-1-(phenylthio)butan-2-one 4-Methoxy-1-phenylsulfanylbutan-2-one 4-Methoxy-1-phenylsulfanyl-butan-2-one
Wiley ID 1208826