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2-Oxo-6-(piperidine-1-sulfonyl)-benzooxazole-3-carboxylic acid isobutyl ester
SpectraBase Compound ID FbjzKww7aI5
InChI InChI=1S/C17H22N2O6S/c1-12(2)11-24-16(20)19-14-7-6-13(10-15(14)25-17(19)21)26(22,23)18-8-4-3-5-9-18/h6-7,10,12H,3-5,8-9,11H2,1-2H3
InChIKey QORIMLQEPSTVOT-UHFFFAOYSA-N
Mol Weight 382.43 g/mol
Molecular Formula C17H22N2O6S
Exact Mass 382.119858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6G306MDpPil
Name 2-Oxo-6-(piperidine-1-sulfonyl)-benzooxazole-3-carboxylic acid isobutyl ester
Alternate Name(s) 2-keto-6-piperidinosulfonyl-1,3-benzoxazole-3-carboxylic acid isobutyl ester 2-Methylpropyl 2-oxidanylidene-6-piperidin-1-ylsulfonyl-1,3-benzoxazole-3-carboxylate 2-Methylpropyl 2-oxo-6-piperidin-1-ylsulfonyl-1,3-benzoxazole-3-carboxylate 2-Oxo-6-(1-piperidinylsulfonyl)-1,3-benzoxazole-3-carboxylic acid 2-methylpropyl ester isobutyl 2-oxo-6-(1-piperidylsulfonyl)-1,3-benzoxazole-3-carboxylate
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Formula C17H22N2O6S
InChI InChI=1S/C17H22N2O6S/c1-12(2)11-24-16(20)19-14-7-6-13(10-15(14)25-17(19)21)26(22,23)18-8-4-3-5-9-18/h6-7,10,12H,3-5,8-9,11H2,1-2H3
InChIKey QORIMLQEPSTVOT-UHFFFAOYSA-N
Molecular Weight 382.431 g/mol
SMILES C1CCN(S(c2ccc3N(C(Oc3c2)=O)C(OCC(C)C)=O)(=O)=O)CC1
SPLASH splash10-001i-9110000000-1f623c6aed44a8f8f521
Wiley ID 1465823