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(4S,5S)-5-(2-acetoxyphenyl)-3-phenyl-2-isoxazoline-4-carboxylic acid ethyl ester
SpectraBase Compound ID 9zrhsKlpT4a
InChI InChI=1S/C20H19NO5/c1-3-24-20(23)17-18(14-9-5-4-6-10-14)21-26-19(17)15-11-7-8-12-16(15)25-13(2)22/h4-12,17,19H,3H2,1-2H3/t17-,19+/m0/s1
InChIKey PVIOMMNQEFEKSN-PKOBYXMFSA-N
Mol Weight 353.37 g/mol
Molecular Formula C20H19NO5
Exact Mass 353.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5HPoqIHQv4n
Name (4S,5S)-5-(2-acetoxyphenyl)-3-phenyl-2-isoxazoline-4-carboxylic acid ethyl ester
Alternate Name(s) (4S,5S)-5-(2-acetyloxyphenyl)-3-phenyl-4,5-dihydroisoxazole-4-carboxylic acid ethyl ester Ethyl (4S,5S)-5-(2-acetoxyphenyl)-3-phenyl-4,5-dihydroisoxazole-4-carboxylate Ethyl (4S,5S)-5-(2-acetyloxyphenyl)-3-phenyl-4,5-dihydro-1,2-oxazole-4-carboxylate
CAS Registry Number 129207-88-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO5
InChI InChI=1S/C20H19NO5/c1-3-24-20(23)17-18(14-9-5-4-6-10-14)21-26-19(17)15-11-7-8-12-16(15)25-13(2)22/h4-12,17,19H,3H2,1-2H3/t17-,19+/m0/s1
InChIKey PVIOMMNQEFEKSN-PKOBYXMFSA-N
Molecular Weight 353.374 g/mol
SMILES [C@@]1([C@](ON=C1c1ccccc1)(c1c(OC(=O)C)cccc1)[H])(C(=O)OCC)[H]
SPLASH splash10-0m1i-0093000000-97fe283831c62e891a9c
Source of Spectrum Y-27-772-13
Wiley ID 1343964