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2-(2-NITROBENZOYL)-CYCLOHEX-1-ENOL
SpectraBase Compound ID 8QHrF4uTBO5
InChI InChI=1S/C13H13NO4/c15-12-8-4-2-6-10(12)13(16)9-5-1-3-7-11(9)14(17)18/h1,3,5,7,15H,2,4,6,8H2
InChIKey RHQRZDPUQOXMLU-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3XFURlTEc61
Name 2-(2-NITROBENZOYL)-CYCLOHEX-1-ENOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c15-12-8-4-2-6-10(12)13(16)9-5-1-3-7-11(9)14(17)18/h1,3,5,7,15H,2,4,6,8H2
InChIKey RHQRZDPUQOXMLU-UHFFFAOYSA-N
Literature Reference Author C.S.WU,J.L.HUANG,Y.S.SUN,D.Y.YANG
Literature Reference Citation J.MED.CHEM.,45,2222(2002)
Literature Reference DOI 10.1021/jm010568y
Molecular Weight 247.251 g/mol
Sample ID 64378
Solvent CDCl3