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5-Methoxycarbonyl-4-tert-butyl-2-trifluoromethylthiophene
SpectraBase Compound ID 1YACwWRt2w3
InChI InChI=1S/C11H13F3O2S/c1-10(2,3)6-5-7(11(12,13)14)17-8(6)9(15)16-4/h5H,1-4H3
InChIKey NKJRMTYQEDVCHX-UHFFFAOYSA-N
Mol Weight 266.28 g/mol
Molecular Formula C11H13F3O2S
Exact Mass 266.058835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A6hsDQQBPxI
Name 5-Methoxycarbonyl-4-tert-butyl-2-trifluoromethylthiophene
Alternate Name(s) Methyl 3-tert-butyl-5-(trifluoromethyl)-2-thiophenecarboxylate 3-tert-Butyl-5-(trifluoromethyl)-2-thiophenecarboxylic acid methyl ester Methyl 3-tert-butyl-5-(trifluoromethyl)thiophene-2-carboxylate
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Formula C11H13F3O2S
InChI InChI=1S/C11H13F3O2S/c1-10(2,3)6-5-7(11(12,13)14)17-8(6)9(15)16-4/h5H,1-4H3
InChIKey NKJRMTYQEDVCHX-UHFFFAOYSA-N
Molecular Weight 266.278 g/mol
SMILES c1(c(cc(s1)C(F)(F)F)C(C)(C)C)C(=O)OC
SPLASH splash10-014i-0190000000-600bf700de98a120e0d9
Source of Spectrum SO-0-463-5
Wiley ID 874438