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(3R,5R)-1-ETHYNYL-5-HYDROXY-2-METHYL-3-[(VINYLOXY)-CARBONYLOXY]-1-CYCLOHEXENE
SpectraBase Compound ID 2TsVbqAb7lk
InChI InChI=1S/C12H14O4/c1-4-9-6-10(13)7-11(8(9)3)16-12(14)15-5-2/h1,5,10-11,13H,2,6-7H2,3H3/t10-,11-/m1/s1
InChIKey YFXQCFXDWCTETF-GHMZBOCLSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8sMBWbpnfPJ
Name (3R,5R)-1-ETHYNYL-5-HYDROXY-2-METHYL-3-[(VINYLOXY)-CARBONYLOXY]-1-CYCLOHEXENE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-4-9-6-10(13)7-11(8(9)3)16-12(14)15-5-2/h1,5,10-11,13H,2,6-7H2,3H3/t10-,11-/m1/s1
InChIKey YFXQCFXDWCTETF-GHMZBOCLSA-N
Literature Reference Author V.GOTOR-FERNANDEZ,M.FERRERO,S.FERNANDEZ,V.GOTOR
Literature Reference Citation J.ORG.CHEM.,64,7504(1999)
Literature Reference DOI 10.1021/jo990813+
Molecular Weight 222.241 g/mol
Sample ID 59478
Solvent CDCl3