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(-)-(1'S,2'R)-[1',2'-EPOXY-4',4'-(ETHYLENEDIOXY)-2',6',6'-TRIMETHYLCYCLOHEXYL]-3-METHYLPENTA-2,4-DIENENITRILE
SpectraBase Compound ID 2K3WErsybO2
InChI InChI=1S/C17H23NO3/c1-13(6-8-18)5-7-17-14(2,3)11-16(19-9-10-20-16)12-15(17,4)21-17/h5-7H,9-12H2,1-4H3/b7-5+,13-6+/t15-,17+/m0/s1
InChIKey IMKUCPHVBZPUFD-VQLDKQPDSA-N
Mol Weight 289.38 g/mol
Molecular Formula C17H23NO3
Exact Mass 289.167794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9NYqLByUftk
Name (-)-(1'S,2'R)-[1',2'-EPOXY-4',4'-(ETHYLENEDIOXY)-2',6',6'-TRIMETHYLCYCLOHEXYL]-3-METHYLPENTA-2,4-DIENENITRILE
Compound Number 6
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Formula C17H23NO3
InChI InChI=1S/C17H23NO3/c1-13(6-8-18)5-7-17-14(2,3)11-16(19-9-10-20-16)12-15(17,4)21-17/h5-7H,9-12H2,1-4H3/b7-5+,13-6+/t15-,17+/m0/s1
InChIKey IMKUCPHVBZPUFD-VQLDKQPDSA-N
Literature Reference Author D.J.BUSCHOR,C.H.EUGSTER
Literature Reference Citation HELV.CHIM.ACTA,73,1002(1990)
Literature Reference DOI 10.1002/hlca.19900730426
Molecular Weight 289.375 g/mol
Solvent CDCl3
Source File Reference UWCS12552