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4-Isoxazolecarboxylic acid, 2,3-dihydro-2,3-diphenyl-, methyl ester
SpectraBase Compound ID IIxyp40IYA9
InChI InChI=1S/C17H15NO3/c1-20-17(19)15-12-21-18(14-10-6-3-7-11-14)16(15)13-8-4-2-5-9-13/h2-12,16H,1H3
InChIKey YSJKUEFWTPGBQR-UHFFFAOYSA-N
Mol Weight 281.31 g/mol
Molecular Formula C17H15NO3
Exact Mass 281.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERzNezraNd8
Name 4-Isoxazolecarboxylic acid, 2,3-dihydro-2,3-diphenyl-, methyl ester
Alternate Name(s) Methyl 2,3-diphenyl-2,3-dihydro-4-isoxazolecarboxylate 2,3-Diphenyl-3H-isoxazole-4-carboxylic acid methyl ester 2,3-Diphenyl-4-isoxazoline-4-carboxylic acid methyl ester Methyl 2,3-diphenyl-3H-1,2-oxazole-4-carboxylate Methyl 2,3-diphenyl-3H-isoxazole-4-carboxylate
CAS Registry Number 117644-85-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15NO3
InChI InChI=1S/C17H15NO3/c1-20-17(19)15-12-21-18(14-10-6-3-7-11-14)16(15)13-8-4-2-5-9-13/h2-12,16H,1H3
InChIKey YSJKUEFWTPGBQR-UHFFFAOYSA-N
Molecular Weight 281.311 g/mol
SMILES COC(C1=CON(c2ccccc2)C1c1ccccc1)=O
SPLASH splash10-00r6-4950000000-97bad5d66e38ee297eb7
Source of Spectrum F-44-1251-9
Wiley ID 1284974