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5-methyl-2-trifluoroacetyl-3-phenylbenzothiophene
SpectraBase Compound ID 9PfrDOa2SF7
InChI InChI=1S/C17H11F3OS/c1-10-7-8-13-12(9-10)14(11-5-3-2-4-6-11)15(22-13)16(21)17(18,19)20/h2-9H,1H3
InChIKey PQASESNPVAQNKP-UHFFFAOYSA-N
Mol Weight 320.33 g/mol
Molecular Formula C17H11F3OS
Exact Mass 320.048271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 93pm8kLA6AK
Name 5-methyl-2-trifluoroacetyl-3-phenylbenzothiophene
Appearance Yellow liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11F3OS
InChI InChI=1S/C17H11F3OS/c1-10-7-8-13-12(9-10)14(11-5-3-2-4-6-11)15(22-13)16(21)17(18,19)20/h2-9H,1H3
InChIKey PQASESNPVAQNKP-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Molecular Weight 320.329 g/mol
SMILES c1cc2c(cc1C)c(c(s2)C(C(F)(F)F)=O)-c1ccccc1
SPLASH splash10-0uk9-0093000000-f62a284704d1ffe88818
Source of Spectrum CN105503822A
Wiley ID 1850852