6-esyl-3-phenyl-6H-fur[3,4-d]isoxazol-4-one

SpectraBase Compound ID	GMrQikG0dAQ
InChI	InChI=1S/C13H11NO5S/c1-2-20(16,17)13-11-9(12(15)18-13)10(14-19-11)8-6-4-3-5-7-8/h3-7,13H,2H2,1H3
InChIKey	DFJWPGULTNRHHY-UHFFFAOYSA-N Google Search
Mol Weight	293.29 g/mol
Molecular Formula	C13H11NO5S
Exact Mass	293.035794 g/mol

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SpectraBase Spectrum ID	9LyyjULO2Jp
Name	6-esyl-3-phenyl-6H-fur[3,4-d]isoxazol-4-one
Alternate Name(s)	6-ethylsulfonyl-3-phenyl-6H-furo[3,4-d]isoxazol-4-one 6-ethylsulfonyl-3-phenyl-6H-furo[3,4-d][1,2]oxazol-4-one
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H11NO5S
InChI	InChI=1S/C13H11NO5S/c1-2-20(16,17)13-11-9(12(15)18-13)10(14-19-11)8-6-4-3-5-7-8/h3-7,13H,2H2,1H3
InChIKey	DFJWPGULTNRHHY-UHFFFAOYSA-N
Molecular Weight	293.293 g/mol
SMILES	c12c(C(=O)OC2S(=O)(=O)CC)c(-c2ccccc2)no1
SPLASH	splash10-0udi-0090000000-5ba6028440a6b1e625f4
Source of Spectrum	F-52-3471-31
Wiley ID	795747