For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
S-methyl 3-(trifluoromethyl)benzothioate
SpectraBase Compound ID 4R24DWoI8mb
InChI InChI=1S/C9H7F3OS/c1-14-8(13)6-3-2-4-7(5-6)9(10,11)12/h2-5H,1H3
InChIKey GHYKKNCSNJRZSF-UHFFFAOYSA-N
Mol Weight 220.21 g/mol
Molecular Formula C9H7F3OS
Exact Mass 220.016971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2luozX4KJFJ
Name S-methyl 3-(trifluoromethyl)benzothioate
Appearance Colourless to light yellow liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7F3OS
InChI InChI=1S/C9H7F3OS/c1-14-8(13)6-3-2-4-7(5-6)9(10,11)12/h2-5H,1H3
InChIKey GHYKKNCSNJRZSF-UHFFFAOYSA-N
Instrument Name Shimadzu-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202000520
Molecular Weight 220.209 g/mol
Reported Formula C9H7F3OS
SMILES c1c(cc(cc1)C(=O)SC)C(F)(F)F
SPLASH splash10-00fs-0900000000-e59e2a99a42fe34e0240
Source of Spectrum AJO-9-SM43-15a
Wiley ID 1855694