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Ethyl 3-(4-trifluoromethylphenyl)-4,5-dihydroisoxazole-5-methyl-4-carboxylate
SpectraBase Compound ID LpuNwU8XfIC
InChI InChI=1S/C14H14F3NO3/c1-3-20-13(19)11-8(2)21-18-12(11)9-4-6-10(7-5-9)14(15,16)17/h4-8,11H,3H2,1-2H3/t8-,11-/m0/s1
InChIKey CTFGWZFBHLLIPJ-KWQFWETISA-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 LvnknPB3Fsl
Name Ethyl 3-(4-trifluoromethylphenyl)-4,5-dihydroisoxazole-5-methyl-4-carboxylate
Alternate Name(s) (4R,5S)-ethyl 5-methyl-3-(4-(trifluoromethyl)phenyl)-4,5-dihydroisoxazole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14F3NO3
InChI InChI=1S/C14H14F3NO3/c1-3-20-13(19)11-8(2)21-18-12(11)9-4-6-10(7-5-9)14(15,16)17/h4-8,11H,3H2,1-2H3/t8-,11-/m0/s1
InChIKey CTFGWZFBHLLIPJ-KWQFWETISA-N
Literature Reference DOI 10.1039/c4ra15975f
Molecular Weight 301.265 g/mol
SMILES [C@]1([C@](C)(ON=C1c1ccc(C(F)(F)F)cc1)[H])(C(OCC)=O)[H]
SPLASH splash10-0006-9361000000-30bfe75ab605c133f126
Source of Spectrum RSA-5-13119-5b
Wiley ID 1760231