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1-TRIFLUOROMETHYL-3-(4-METHOXYSTYRYL)-2-EN-1-ONE
SpectraBase Compound ID ISaPUegyGhW
InChI InChI=1S/C11H9F3O2/c1-16-9-5-2-8(3-6-9)4-7-10(15)11(12,13)14/h2-7H,1H3/b7-4+
InChIKey UUEUIHMPHYBCFZ-QPJJXVBHSA-N
Mol Weight 230.19 g/mol
Molecular Formula C11H9F3O2
Exact Mass 230.055464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5MK8vw9F2Cf
Name (E)-1,1,1-Trifluoro-4-(4-methoxyphenyl)but-3-en-2-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 230.055464017 u
Formula C11H9F3O2
InChI InChI=1S/C11H9F3O2/c1-16-9-5-2-8(3-6-9)4-7-10(15)11(12,13)14/h2-7H,1H3/b7-4+
InChIKey UUEUIHMPHYBCFZ-QPJJXVBHSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201804614
Molecular Weight 230.186 g/mol
Quality 207
Reported Formula C11H9O2F3
SMILES C(\C=C\C1=CC=C(C=C1)OC)(=O)C(F)(F)F
SPLASH splash10-03e9-5920000000-fb7b0c72fdce950be103
Source of Spectrum ACI-57-SM24-SI-4d (DOI: 10.1002/anie.201804614)
Thin-Layer Chromatography 0.60 (petroleum ether/EtOAc, 9:1)
Wiley ID 1893069