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(3R,5R)-5-ACETOXY-1-ETHYNYL-2-METHYL-3-PHTHALIMIDOCYCLOHEX-1-ENE
SpectraBase Compound ID JoiEC2dllHR
InChI InChI=1S/C19H17NO4/c1-4-13-9-14(24-12(3)21)10-17(11(13)2)20-18(22)15-7-5-6-8-16(15)19(20)23/h1,5-8,14,17H,9-10H2,2-3H3/t14-,17+/m1/s1
InChIKey BGDCOWUUCYSXNS-PBHICJAKSA-N
Mol Weight 323.35 g/mol
Molecular Formula C19H17NO4
Exact Mass 323.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HJf9ruaTlEL
Name (3R,5R)-5-ACETOXY-1-ETHYNYL-2-METHYL-3-PHTHALIMIDOCYCLOHEX-1-ENE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H17NO4
InChI InChI=1S/C19H17NO4/c1-4-13-9-14(24-12(3)21)10-17(11(13)2)20-18(22)15-7-5-6-8-16(15)19(20)23/h1,5-8,14,17H,9-10H2,2-3H3/t14-,17+/m1/s1
InChIKey BGDCOWUUCYSXNS-PBHICJAKSA-N
Literature Reference Author D.OVES,M.FERRERO,S.FERNANDEZ,V.GOTOR
Literature Reference Citation J.ORG.CHEM.,68,1154(2003)
Literature Reference DOI 10.1021/jo026474t
Molecular Weight 323.348 g/mol
Solvent CDCl3
Source File Reference UWLU22941