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(3R,5R)-5-ACETOXY-1-ETHYNYL-2-METHYL-3-[(4-NITROPHENYL)-CARBONYLOXY]-CYCLOHEX-1-ENE
SpectraBase Compound ID 6KlNJL9URDH
InChI InChI=1S/C18H17NO6/c1-4-13-9-16(24-12(3)20)10-17(11(13)2)25-18(21)14-5-7-15(8-6-14)19(22)23/h1,5-8,16-17H,9-10H2,2-3H3/t16-,17-/m1/s1
InChIKey WQONVIISRPOILM-IAGOWNOFSA-N
Mol Weight 343.34 g/mol
Molecular Formula C18H17NO6
Exact Mass 343.105587 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KQ2umQFmUrq
Name (3R,5R)-5-ACETOXY-1-ETHYNYL-2-METHYL-3-[(4-NITROPHENYL)-CARBONYLOXY]-CYCLOHEX-1-ENE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H17NO6
InChI InChI=1S/C18H17NO6/c1-4-13-9-16(24-12(3)20)10-17(11(13)2)25-18(21)14-5-7-15(8-6-14)19(22)23/h1,5-8,16-17H,9-10H2,2-3H3/t16-,17-/m1/s1
InChIKey WQONVIISRPOILM-IAGOWNOFSA-N
Literature Reference Author V.G.FERNANDEZ,M.FERRERO,S.FERNANDEZ,V.GOTOR
Literature Reference Citation J.ORG.CHEM.,67,1266(2002)
Literature Reference DOI 10.1021/jo010941+
Molecular Weight 343.336 g/mol
Solvent CDCl3
Source File Reference UWLU24945