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6-methyl-2-trifluoroacetyl-3-phenylbenzothiophene
SpectraBase Compound ID FSMxDcHPxXe
InChI InChI=1S/C17H11F3OS/c1-10-7-8-12-13(9-10)22-15(16(21)17(18,19)20)14(12)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey PDUQKRDKWQXPIV-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 9kNSLGjRKKW
Name 6-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/c1-10-7-8-12-13(9-10)22-15(16(21)17(18,19)20)14(12)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey PDUQKRDKWQXPIV-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Molecular Weight 320.329 g/mol
SMILES c1(cc2c(cc1)c(c(s2)C(C(F)(F)F)=O)-c1ccccc1)C
SPLASH splash10-0uk9-0194000000-24baef91fa345680e200
Source of Spectrum CN105503822A
Wiley ID 1850853