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(3-Methyloxetan-3-yl)-methyl 3-(4-trifluoromethylphenyl)-4,5-dihydroisoxazole-4-methyl-5-carboxylate

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(3-Methyloxetan-3-yl)-methyl 3-(4-trifluoromethylphenyl)-4,5-dihydroisoxazole-4-methyl-5-carboxylate
SpectraBase Compound ID H4sJIqCdDFk
InChI InChI=1S/C17H18F3NO4/c1-10-13(11-3-5-12(6-4-11)17(18,19)20)21-25-14(10)15(22)24-9-16(2)7-23-8-16/h3-6,10,14H,7-9H2,1-2H3/t10-,14-/m1/s1
InChIKey LCXSCIFPQGJDHW-QMTHXVAHSA-N
Mol Weight 357.33 g/mol
Molecular Formula C17H18F3NO4
Exact Mass 357.118793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EaILXWXZu5f
Name (3-Methyloxetan-3-yl)-methyl 3-(4-trifluoromethylphenyl)-4,5-dihydroisoxazole-4-methyl-5-carboxylate
Alternate Name(s) (4R,5R)-(3-methyloxetan-3-yl)methyl 4-methyl-3-(4-(trifluoromethyl)phenyl)-4,5-dihydroisoxazole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18F3NO4
InChI InChI=1S/C17H18F3NO4/c1-10-13(11-3-5-12(6-4-11)17(18,19)20)21-25-14(10)15(22)24-9-16(2)7-23-8-16/h3-6,10,14H,7-9H2,1-2H3/t10-,14-/m1/s1
InChIKey LCXSCIFPQGJDHW-QMTHXVAHSA-N
Literature Reference DOI 10.1039/c4ra15975f
Molecular Weight 357.329 g/mol
SMILES [C@@]1(C)([C@](C(=O)OCC2(COC2)C)(ON=C1c1ccc(C(F)(F)F)cc1)[H])[H]
SPLASH splash10-00b9-7591000000-e30a8e0543386a4a5943
Source of Spectrum RSA-5-13121-6k
Wiley ID 1760242