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S-methyl 4-fluoro-3-methylbenzothioate
SpectraBase Compound ID BPNGBq3xufG
InChI InChI=1S/C9H9FOS/c1-6-5-7(9(11)12-2)3-4-8(6)10/h3-5H,1-2H3
InChIKey YJKOWRRWZQYQID-UHFFFAOYSA-N
Mol Weight 184.23 g/mol
Molecular Formula C9H9FOS
Exact Mass 184.035814 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5lj6B6ESLeD
Name S-methyl 4-fluoro-3-methylbenzothioate
Appearance Light yellow liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9FOS
InChI InChI=1S/C9H9FOS/c1-6-5-7(9(11)12-2)3-4-8(6)10/h3-5H,1-2H3
InChIKey YJKOWRRWZQYQID-UHFFFAOYSA-N
Instrument Name Shimadzu-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202000520
Molecular Weight 184.228 g/mol
Reported Formula C9H9FOS
SMILES c1(F)c(cc(cc1)C(=O)SC)C
SPLASH splash10-000i-1900000000-f80b32c0d061fa1ecf83
Source of Spectrum AJO-9-SM55-22a
Wiley ID 1855700