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[1-ALPHA,2-ALPHA-(Z),3-ALPHA]-(+/-)-3-[(2-METHOXYETHOXY)-METHOXY]-2-(2-PENTENYL)-CYCLOPENTANEACETONITRILE
SpectraBase Compound ID KGhMvRVzDou
InChI InChI=1S/C16H27NO3/c1-3-4-5-6-15-14(9-10-17)7-8-16(15)20-13-19-12-11-18-2/h4-5,14-16H,3,6-9,11-13H2,1-2H3/b5-4-/t14-,15+,16-/m1/s1
InChIKey BBZJEIDMESUUEY-IPUTUCIWSA-N
Mol Weight 281.4 g/mol
Molecular Formula C16H27NO3
Exact Mass 281.199094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Jar3WJnmSZ
Name [1-ALPHA,2-ALPHA-(Z),3-ALPHA]-(+/-)-3-[(2-METHOXYETHOXY)-METHOXY]-2-(2-PENTENYL)-CYCLOPENTANEACETONITRILE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H27NO3
InChI InChI=1S/C16H27NO3/c1-3-4-5-6-15-14(9-10-17)7-8-16(15)20-13-19-12-11-18-2/h4-5,14-16H,3,6-9,11-13H2,1-2H3/b5-4-/t14-,15+,16-/m1/s1
InChIKey BBZJEIDMESUUEY-IPUTUCIWSA-N
Literature Reference Author M.SANNIGRAHI,D.L.MAYHEW,D.L.J.CLIVE
Literature Reference Citation J.ORG.CHEM.,64,2776(1999)
Literature Reference DOI 10.1021/jo982225m
Molecular Weight 281.395 g/mol
Sample ID 58794
Solvent CD2Cl2