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Ethyl 3-(4-trifluoromethylphenyl)-4,5-dihydroisoxazole-4-methyl-5-carboxylate
SpectraBase Compound ID K0JUDGydTv0
InChI InChI=1S/C14H14F3NO3/c1-3-20-13(19)12-8(2)11(18-21-12)9-4-6-10(7-5-9)14(15,16)17/h4-8,12H,3H2,1-2H3/t8-,12-/m1/s1
InChIKey AMRHSNWGKMKKQT-PRHODGIISA-N
Mol Weight 301.27 g/mol
Molecular Formula C14H14F3NO3
Exact Mass 301.092578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DuoE6fXJuRx
Name Ethyl 3-(4-trifluoromethylphenyl)-4,5-dihydroisoxazole-4-methyl-5-carboxylate
Alternate Name(s) (4R,5R)-ethyl 4-methyl-3-(4-(trifluoromethyl)phenyl)-4,5-dihydroisoxazole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14F3NO3
InChI InChI=1S/C14H14F3NO3/c1-3-20-13(19)12-8(2)11(18-21-12)9-4-6-10(7-5-9)14(15,16)17/h4-8,12H,3H2,1-2H3/t8-,12-/m1/s1
InChIKey AMRHSNWGKMKKQT-PRHODGIISA-N
Literature Reference DOI 10.1039/c4ra15975f
Molecular Weight 301.265 g/mol
SMILES [C@]1([C@](C(=O)OCC)(ON=C1c1ccc(C(F)(F)F)cc1)[H])(C)[H]
SPLASH splash10-004i-0490000000-84ebf27e72b8ee4a401c
Source of Spectrum RSA-5-13119-6b
Wiley ID 1760237