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N-(TRANS-2-IODOCYClOHEXYL)-N'-(PARA-METHYLPHENACYL)-UREA
SpectraBase Compound ID JBdbskRiabn
InChI InChI=1S/C16H21IN2O2/c1-11-6-8-12(9-7-11)15(20)10-18-16(21)19-14-5-3-2-4-13(14)17/h6-9,13-14H,2-5,10H2,1H3,(H2,18,19,21)/t13-,14-/m0/s1
InChIKey LPYWZIAFXAAQNC-KBPBESRZSA-N
Mol Weight 400.26 g/mol
Molecular Formula C16H21IN2O2
Exact Mass 400.064773 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7u61Pl3NjKq
Name N-(TRANS-2-IODOCYClOHEXYL)-N'-(PARA-METHYLPHENACYL)-UREA
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H21IN2O2
InChI InChI=1S/C16H21IN2O2/c1-11-6-8-12(9-7-11)15(20)10-18-16(21)19-14-5-3-2-4-13(14)17/h6-9,13-14H,2-5,10H2,1H3,(H2,18,19,21)/t13-,14-/m0/s1
InChIKey LPYWZIAFXAAQNC-KBPBESRZSA-N
Literature Reference Author J.M.G.FERNANDEZ,C.O.MELLET,M.A.P.ADRIAN,J.F.MOTA
Literature Reference Citation J.HETCYCL.CHEM.,28,777(1991)
Literature Reference DOI 10.1002/jhet.5570280339
Molecular Weight 400.259 g/mol
Solvent CDCl3
Source File Reference UWCS16994