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2-trifluoroacetyl-3-(3-methylphenyl)benzothiophene
SpectraBase Compound ID EgjuEUTbVly
InChI InChI=1S/C17H11F3OS/c1-10-5-4-6-11(9-10)14-12-7-2-3-8-13(12)22-15(14)16(21)17(18,19)20/h2-9H,1H3
InChIKey BYJXNWCICHYQFM-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 EnsYlmLkwoT
Name 2-trifluoroacetyl-3-(3-methylphenyl)benzothiophene
Appearance Yellow liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11F3OS
InChI InChI=1S/C17H11F3OS/c1-10-5-4-6-11(9-10)14-12-7-2-3-8-13(12)22-15(14)16(21)17(18,19)20/h2-9H,1H3
InChIKey BYJXNWCICHYQFM-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Molecular Weight 320.329 g/mol
SMILES c1cc2c(cc1)c(c(s2)C(C(F)(F)F)=O)-c1cc(ccc1)C
SPLASH splash10-0uk9-0195000000-3f1eb4d1a19fc375e4d1
Source of Spectrum CN105503822A
Wiley ID 1850845