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1-[(1R,2S)-TRANS-(2-PHENYLCYCLOHEXYL)-OXY]-PENT-4-ENE-1-YNE
SpectraBase Compound ID 4fSZYxngbsc
InChI InChI=1S/C17H20O/c1-2-3-9-14-18-17-13-8-7-12-16(17)15-10-5-4-6-11-15/h2,4-6,10-11,16-17H,1,3,7-8,12-13H2/t16-,17+/m1/s1
InChIKey ZNHDHGYICLIODU-SJORKVTESA-N
Mol Weight 240.35 g/mol
Molecular Formula C17H20O
Exact Mass 240.151415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Br4jvht456H
Name 1-[(1R,2S)-TRANS-(2-PHENYLCYCLOHEXYL)-OXY]-PENT-4-ENE-1-YNE
Compound Number (-)-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20O
InChI InChI=1S/C17H20O/c1-2-3-9-14-18-17-13-8-7-12-16(17)15-10-5-4-6-11-15/h2,4-6,10-11,16-17H,1,3,7-8,12-13H2/t16-,17+/m1/s1
InChIKey ZNHDHGYICLIODU-SJORKVTESA-N
Literature Reference Author S.E.DENMARK,J.A.DIXON
Literature Reference Citation J.ORG.CHEM.,63,6178(1998)
Literature Reference DOI 10.1021/jo9802170
Molecular Weight 240.345 g/mol
Sample ID 28859
Solvent CDCl3