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S-Methyl 4-phenoxybenzothioate
SpectraBase Compound ID LTxbpKJnlWL
InChI InChI=1S/C14H12O2S/c1-17-14(15)11-7-9-13(10-8-11)16-12-5-3-2-4-6-12/h2-10H,1H3
InChIKey TVJGQWATWSGVSF-UHFFFAOYSA-N
Mol Weight 244.31 g/mol
Molecular Formula C14H12O2S
Exact Mass 244.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9NiAMwdZUim
Name S-Methyl 4-phenoxybenzothioate
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O2S
InChI InChI=1S/C14H12O2S/c1-17-14(15)11-7-9-13(10-8-11)16-12-5-3-2-4-6-12/h2-10H,1H3
InChIKey TVJGQWATWSGVSF-UHFFFAOYSA-N
Instrument Name Shimadzu 2010
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00665
Molecular Weight 244.308 g/mol
SMILES CSC(c1ccc(cc1)Oc1ccccc1)=O
SPLASH splash10-0002-1900000000-45ccf97c920d705fd614
Source of Spectrum JOC-86-8801-3h
Wiley ID 1867840