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5-(3,5-Bis(trifluoromethyl)phenyl)thiophene-2-carboxylic acid methyl ester
SpectraBase Compound ID D2Qu64DRIAA
InChI InChI=1S/C14H8F6O2S/c1-22-12(21)11-3-2-10(23-11)7-4-8(13(15,16)17)6-9(5-7)14(18,19)20/h2-6H,1H3
InChIKey QYQOXFXLVIUZCX-UHFFFAOYSA-N
Mol Weight 354.27 g/mol
Molecular Formula C14H8F6O2S
Exact Mass 354.01492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1H5IZJTw4n3
Name 5-(3,5-Bis(trifluoromethyl)phenyl)thiophene-2-carboxylic acid methyl ester
Alternate Name(s) Methyl 5-[3,5-bis(trifluoromethyl)phenyl]-2-thiophenecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8F6O2S
InChI InChI=1S/C14H8F6O2S/c1-22-12(21)11-3-2-10(23-11)7-4-8(13(15,16)17)6-9(5-7)14(18,19)20/h2-6H,1H3
InChIKey QYQOXFXLVIUZCX-UHFFFAOYSA-N
Molecular Weight 354.266 g/mol
SMILES c1(ccc(s1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(=O)OC
SPLASH splash10-0udi-0059000000-baf2c793f483d23b27f4
Source of Spectrum J-64-3890-5
Wiley ID 1530219