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Ethyl 3-benzoyl-2,4-diphenyl-2,3-dihydro-5-isoxazolecarboxylate
SpectraBase Compound ID 5yWX3vxoacL
InChI InChI=1S/C25H21NO4/c1-2-29-25(28)24-21(18-12-6-3-7-13-18)22(23(27)19-14-8-4-9-15-19)26(30-24)20-16-10-5-11-17-20/h3-17,22H,2H2,1H3
InChIKey RYNOPPSYYYFSKS-UHFFFAOYSA-N
Mol Weight 399.45 g/mol
Molecular Formula C25H21NO4
Exact Mass 399.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cyxwd92tuxW
Name Ethyl 3-benzoyl-2,4-diphenyl-2,3-dihydro-5-isoxazolecarboxylate
Alternate Name(s) 3-Benzoyl-2,4-diphenyl-3H-isoxazole-5-carboxylic acid ethyl ester 3-Benzoyl-2,4-diphenyl-4-isoxazoline-5-carboxylic acid ethyl ester 5-Isoxazolecarboxylic acid, 3-benzoyl-2,3-dihydro-2,5-diphenyl-, ethyl ester Ethyl 2,4-diphenyl-3-(phenylcarbonyl)-3H-1,2-oxazole-5-carboxylate Ethyl 3-benzoyl-2,4-diphenyl-3H-1,2-oxazole-5-carboxylate Ethyl 3-benzoyl-2,4-diphenyl-3H-isoxazole-5-carboxylate
CAS Registry Number 117644-68-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21NO4
InChI InChI=1S/C25H21NO4/c1-2-29-25(28)24-21(18-12-6-3-7-13-18)22(23(27)19-14-8-4-9-15-19)26(30-24)20-16-10-5-11-17-20/h3-17,22H,2H2,1H3
InChIKey RYNOPPSYYYFSKS-UHFFFAOYSA-N
Molecular Weight 399.446 g/mol
SMILES CCOC(C1=C(c2ccccc2)C(C(c2ccccc2)=O)N(c2ccccc2)O1)=O
SPLASH splash10-052f-2980000000-a817aa95aa88c74e0b0e
Source of Spectrum F-44-1262-17
Wiley ID 1369086