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Ethyl N-Methyl-3-propoxy-5-phenyl-3-trifluoromethylisoxazolidine-4-carboxylate isomer
SpectraBase Compound ID DGxXagEvsV3
InChI InChI=1S/C17H22F3NO4/c1-4-11-24-16(17(18,19)20)13(15(22)23-5-2)14(21(3)25-16)12-9-7-6-8-10-12/h6-10,13-14H,4-5,11H2,1-3H3/t13-,14-,16+/m0/s1
InChIKey RIPVYRXMPVYAAW-OFQRWUPVSA-N
Mol Weight 361.36 g/mol
Molecular Formula C17H22F3NO4
Exact Mass 361.150093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID j9iV9srBws
Name Ethyl N-Methyl-3-propoxy-5-phenyl-3-trifluoromethylisoxazolidine-4-carboxylate isomer
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Formula C17H22F3NO4
InChI InChI=1S/C17H22F3NO4/c1-4-11-24-16(17(18,19)20)13(15(22)23-5-2)14(21(3)25-16)12-9-7-6-8-10-12/h6-10,13-14H,4-5,11H2,1-3H3/t13-,14-,16+/m0/s1
InChIKey RIPVYRXMPVYAAW-OFQRWUPVSA-N
Molecular Weight 361.361 g/mol
SMILES [C@]1([C@@]([C@](c2ccccc2)(N(O1)C)[H])(C(=O)OCC)[H])(C(F)(F)F)OCCC
SPLASH splash10-03dr-0809000000-2ce362490d8e705be59c
Source of Spectrum F-52-69-23
Synonyms (3R,4R,5R)-2-Methyl-3-phenyl-5-propoxy-5-trifluoromethyl-isoxazolidine-4-carboxylic acid ethyl ester
Wiley ID 794630