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TRANS,CIS-6-(PARA-CYANOPHENYL)-2,2,6-TRIMETHYL-3-OXABICYCLO-[3.3.0]-OCTANE
SpectraBase Compound ID C1cGB2Qg1wg
InChI InChI=1S/C17H21NO/c1-16(2)14-8-9-17(3,15(14)11-19-16)13-6-4-12(10-18)5-7-13/h4-7,14-15H,8-9,11H2,1-3H3/t14-,15+,17+/m1/s1
InChIKey WTWGMZKWQWHBBT-VYDXJSESSA-N
Mol Weight 255.36 g/mol
Molecular Formula C17H21NO
Exact Mass 255.162314 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6VPLPLx5Dms
Name TRANS,CIS-6-(PARA-CYANOPHENYL)-2,2,6-TRIMETHYL-3-OXABICYCLO-[3.3.0]-OCTANE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H21NO
InChI InChI=1S/C17H21NO/c1-16(2)14-8-9-17(3,15(14)11-19-16)13-6-4-12(10-18)5-7-13/h4-7,14-15H,8-9,11H2,1-3H3/t14-,15+,17+/m1/s1
InChIKey WTWGMZKWQWHBBT-VYDXJSESSA-N
Literature Reference Author H.WENG,C.SCARLATA,H.D.ROTH
Literature Reference Citation J.AM.CHEM.SOC.,118,10947(1996)
Literature Reference DOI 10.1021/ja962206z
Molecular Weight 255.360 g/mol
Sample ID 53553
Solvent CDCl3