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(1S*,4R*,4AS*,5S*,8AR*)-7-(BUT-3-EN-1-YN-1-YL)-8,8-DIMETHOXY-1,4,4A,5,8,8A-HEXAHYDRO-1,4-METHANONAPHTHALEN-5-OL
SpectraBase Compound ID Ispgx0kxw1x
InChI InChI=1S/C17H20O3/c1-4-5-6-13-10-14(18)15-11-7-8-12(9-11)16(15)17(13,19-2)20-3/h4,7-8,10-12,14-16,18H,1,9H2,2-3H3/t11-,12+,14+,15+,16+/m0/s1
InChIKey VSLWDQLJLTVULS-OVJXPFRRSA-N
Mol Weight 272.34 g/mol
Molecular Formula C17H20O3
Exact Mass 272.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ynlFbaIGKM
Name (1S*,4R*,4AS*,5S*,8AR*)-7-(BUT-3-EN-1-YN-1-YL)-8,8-DIMETHOXY-1,4,4A,5,8,8A-HEXAHYDRO-1,4-METHANONAPHTHALEN-5-OL
Compound Number 21B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20O3
InChI InChI=1S/C17H20O3/c1-4-5-6-13-10-14(18)15-11-7-8-12(9-11)16(15)17(13,19-2)20-3/h4,7-8,10-12,14-16,18H,1,9H2,2-3H3/t11-,12+,14+,15+,16+/m0/s1
InChIKey VSLWDQLJLTVULS-OVJXPFRRSA-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 272.344 g/mol
Solvent TOLUENE-D8
Source File Reference UWBT21327