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(1S*,4R*,4AS*,8AR*)-7-(BUT-3-EN-1-YN-1-YL)-8,8-DIMETHOXY-4,4A,8,8A-TETRAHYDRO-1,4-METHANONAPHTHALEN-5(1H)-ONE
SpectraBase Compound ID 4yZbf96gX9U
InChI InChI=1S/C17H18O3/c1-4-5-6-13-10-14(18)15-11-7-8-12(9-11)16(15)17(13,19-2)20-3/h4,7-8,10-12,15-16H,1,9H2,2-3H3/t11-,12+,15+,16+/m0/s1
InChIKey AOBVVWMGVSJMNE-UAXWRAGISA-N
Mol Weight 270.33 g/mol
Molecular Formula C17H18O3
Exact Mass 270.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K8QrUETIbJv
Name (1S*,4R*,4AS*,8AR*)-7-(BUT-3-EN-1-YN-1-YL)-8,8-DIMETHOXY-4,4A,8,8A-TETRAHYDRO-1,4-METHANONAPHTHALEN-5(1H)-ONE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18O3
InChI InChI=1S/C17H18O3/c1-4-5-6-13-10-14(18)15-11-7-8-12(9-11)16(15)17(13,19-2)20-3/h4,7-8,10-12,15-16H,1,9H2,2-3H3/t11-,12+,15+,16+/m0/s1
InChIKey AOBVVWMGVSJMNE-UAXWRAGISA-N
Literature Reference Author D.R.HOOKINS,A.R.BURNS,R.J.K.TAYLOR
Literature Reference Citation EUR.J.ORG.CHEM.,2011,451(2011)
Literature Reference DOI 10.1002/ejoc.201001402
Molecular Weight 270.328 g/mol
Solvent TOLUENE-D8
Source File Reference UWBT21325