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(E)-4-(1'-NITRO-2'-OXO-CYCLODODECYL)-3-BUTEN-2-ONE
SpectraBase Compound ID GzY822VFAfu
InChI InChI=1S/C16H25NO4/c1-14(18)11-13-16(17(20)21)12-9-7-5-3-2-4-6-8-10-15(16)19/h11,13H,2-10,12H2,1H3/b13-11+
InChIKey ABTWCOYJYKVDES-ACCUITESSA-N
Mol Weight 295.38 g/mol
Molecular Formula C16H25NO4
Exact Mass 295.178358 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AR885QSEmJz
Name (E)-4-(1'-NITRO-2'-OXO-CYCLODODECYL)-3-BUTEN-2-ONE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H25NO4
InChI InChI=1S/C16H25NO4/c1-14(18)11-13-16(17(20)21)12-9-7-5-3-2-4-6-8-10-15(16)19/h11,13H,2-10,12H2,1H3/b13-11+
InChIKey ABTWCOYJYKVDES-ACCUITESSA-N
Literature Reference Author G.GIORGI,P.LOPEZ-ALVARDO,S.MIRAND,J.RODRIGUEZ,J.C.MENENDEZ
Literature Reference Citation EUR.J.ORG.CHEM.,2013,1327(2013)
Literature Reference DOI 10.1002/ejoc.201201431
Molecular Weight 295.379 g/mol
Solvent CDCl3
Source File Reference UWBT17627