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S-Benzyl 4-fluorobenzothioate
SpectraBase Compound ID IYjbwx12zHt
InChI InChI=1S/C14H11FOS/c15-13-8-6-12(7-9-13)14(16)17-10-11-4-2-1-3-5-11/h1-9H,10H2
InChIKey PJXZUGJKNBBJHG-UHFFFAOYSA-N
Mol Weight 246.3 g/mol
Molecular Formula C14H11FOS
Exact Mass 246.051464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DPFRQ38aBNw
Name S-Benzyl 4-fluorobenzothioate
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11FOS
InChI InChI=1S/C14H11FOS/c15-13-8-6-12(7-9-13)14(16)17-10-11-4-2-1-3-5-11/h1-9H,10H2
InChIKey PJXZUGJKNBBJHG-UHFFFAOYSA-N
Instrument Name Shimadzu 2010
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00665
Molecular Weight 246.299 g/mol
SMILES c1(ccccc1)CSC(c1ccc(cc1)F)=O
SPLASH splash10-00di-2900000000-2e36b3695862cfff0af8
Source of Spectrum JOC-86-8802-3v
Wiley ID 1867853