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3-(4-methyl-benzoyl)-4,5-dihydroisoxazolyl-5-carboxylic acid butyl ester
SpectraBase Compound ID JOiYtju1VI2
InChI InChI=1S/C16H19NO4/c1-3-4-9-20-16(19)14-10-13(17-21-14)15(18)12-7-5-11(2)6-8-12/h5-8,14H,3-4,9-10H2,1-2H3
InChIKey XESIXXANIQIEKB-UHFFFAOYSA-N
Mol Weight 289.33 g/mol
Molecular Formula C16H19NO4
Exact Mass 289.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYF37y0UqDz
Name 3-(4-methyl-benzoyl)-4,5-dihydroisoxazolyl-5-carboxylic acid butyl ester
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Formula C16H19NO4
InChI InChI=1S/C16H19NO4/c1-3-4-9-20-16(19)14-10-13(17-21-14)15(18)12-7-5-11(2)6-8-12/h5-8,14H,3-4,9-10H2,1-2H3
InChIKey XESIXXANIQIEKB-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 289.331 g/mol
Reported Formula C16H20NO4
SMILES C1(=NOC(C1)C(=O)OCCCC)C(c1ccc(cc1)C)=O
SPLASH splash10-014i-4900000000-9fb8e0e00e7ae44666cb
Source of Spectrum CN104910090A
Wiley ID 1850451