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(anilinomethylene)malonic acid, cyclic isopropylidene ester
SpectraBase Compound ID 3jOXVGJMKSv
InChI InChI=1S/C13H13NO4/c1-13(2)17-11(15)10(12(16)18-13)8-14-9-6-4-3-5-7-9/h3-8,14H,1-2H3
InChIKey GTAWFIKDUIDKEP-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6KyG0nZ4Iq4
Name 3-ANILINOMETHYLENE-1,5-DIOXA-2,4-DIOXO-6,6-DIMETHYLCYCLOHEXAN
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-13(2)17-11(15)10(12(16)18-13)8-14-9-6-4-3-5-7-9/h3-8,14H,1-2H3
InChIKey GTAWFIKDUIDKEP-UHFFFAOYSA-N
Literature Reference Author J.C.ZHUO
Literature Reference Citation MAGN.RES.CHEM.,35,432(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199707)35:7<432::aid-omr107>3.0.co;2-f
Solvent CD3CN;0.5M
Source File Reference UWSI9766