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CIS-4-ISOPROPENYL-1-(4-NITROBENZOYLOXY)-CYCLOHEXANECARBONITRILE
SpectraBase Compound ID 1hF02JpFfYD
InChI InChI=1S/C17H18N2O4/c1-12(2)13-7-9-17(11-18,10-8-13)23-16(20)14-3-5-15(6-4-14)19(21)22/h3-6,13H,1,7-10H2,2H3/t13-,17+
InChIKey XUUZDYJOSSEIIL-XFHMXUHZSA-N
Mol Weight 314.34 g/mol
Molecular Formula C17H18N2O4
Exact Mass 314.126657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gi4YEhxsios
Name CIS-4-ISOPROPENYL-1-(4-NITROBENZOYLOXY)-CYCLOHEXANECARBONITRILE
Compound Number 2F'
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18N2O4
InChI InChI=1S/C17H18N2O4/c1-12(2)13-7-9-17(11-18,10-8-13)23-16(20)14-3-5-15(6-4-14)19(21)22/h3-6,13H,1,7-10H2,2H3/t13-,17+
InChIKey XUUZDYJOSSEIIL-XFHMXUHZSA-N
Literature Reference Author F.EFFENGERGER,J.ROOS,C.KOBLER,H.BUEHLER
Literature Reference Citation CAN.J.CHEM.,80,671(2002)
Literature Reference DOI 10.1139/v02-087
Molecular Weight 314.341 g/mol
Solvent CDCl3
Source File Reference UWLU29872