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(4S,5S)-5-(2-hydroxyphenyl)-3-phenyl-2-isoxazoline-4-carboxylic acid ethyl ester
SpectraBase Compound ID CdKycgLPaD7
InChI InChI=1S/C18H17NO4/c1-2-22-18(21)15-16(12-8-4-3-5-9-12)19-23-17(15)13-10-6-7-11-14(13)20/h3-11,15,17,20H,2H2,1H3/t15-,17+/m0/s1
InChIKey PRWAEKVACSYLCP-DOTOQJQBSA-N
Mol Weight 311.34 g/mol
Molecular Formula C18H17NO4
Exact Mass 311.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMmsmwhNcSe
Name (4S,5S)-5-(2-hydroxyphenyl)-3-phenyl-2-isoxazoline-4-carboxylic acid ethyl ester
CAS Registry Number 129207-82-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO4
InChI InChI=1S/C18H17NO4/c1-2-22-18(21)15-16(12-8-4-3-5-9-12)19-23-17(15)13-10-6-7-11-14(13)20/h3-11,15,17,20H,2H2,1H3/t15-,17+/m0/s1
InChIKey PRWAEKVACSYLCP-DOTOQJQBSA-N
Molecular Weight 311.337 g/mol
SMILES Oc1c([C@@]2([C@](C(=NO2)c2ccccc2)(C(=O)OCC)[H])[H])cccc1
SPLASH splash10-00or-0891000000-b3dbbe2fd1b1a45b3d03
Source of Spectrum Y-27-772-6
Synonyms (4S,5S)-5-(2-hydroxyphenyl)-3-phenyl-4,5-dihydroisoxazole-4-carboxylic acid ethyl ester Ethyl (4S,5S)-5-(2-hydroxyphenyl)-3-phenyl-4,5-dihydro-1,2-oxazole-4-carboxylate Ethyl (4S,5S)-5-(2-hydroxyphenyl)-3-phenyl-4,5-dihydroisoxazole-4-carboxylate
Wiley ID 1312494