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S-methyl 3,4-difluorobenzothioate
SpectraBase Compound ID FnhIn2zo3Ty
InChI InChI=1S/C8H6F2OS/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4H,1H3
InChIKey NTCJKQAPKPVASO-UHFFFAOYSA-N
Mol Weight 188.19 g/mol
Molecular Formula C8H6F2OS
Exact Mass 188.010742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L4pB9dhHtZI
Name S-methyl 3,4-difluorobenzothioate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6F2OS
InChI InChI=1S/C8H6F2OS/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4H,1H3
InChIKey NTCJKQAPKPVASO-UHFFFAOYSA-N
Instrument Name Shimadzu-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202000520
Molecular Weight 188.192 g/mol
Reported Formula C8H6F2OS
SMILES c1(F)c(cc(cc1)C(=O)SC)F
SPLASH splash10-01ox-0900000000-55a2b387c5bed82ce71d
Source of Spectrum AJO-9-SM47-17a
Wiley ID 1855696