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(3R,4AR,5S,8R,8AS)-3-[(R)-2'-OCTYLOXY]-4A,5,8,8A-TETRAHYDRO-5,8-ETHANO-1H-2-BENZOPYRAN-4(3H)-ONE;ALPHA-ENDO-ADDUCT
SpectraBase Compound ID 1TQYn6wRHgs
InChI InChI=1S/C19H30O3/c1-3-4-5-6-7-13(2)22-19-18(20)17-15-10-8-14(9-11-15)16(17)12-21-19/h8,10,13-17,19H,3-7,9,11-12H2,1-2H3/t13-,14-,15+,16-,17+,19+/m0/s1
InChIKey QJNSYDZAUALDOU-AMQNGPJSSA-N
Mol Weight 306.45 g/mol
Molecular Formula C19H30O3
Exact Mass 306.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KsnYidClQ6z
Name (3R,4AR,5S,8R,8AS)-3-[(R)-2'-OCTYLOXY]-4A,5,8,8A-TETRAHYDRO-5,8-ETHANO-1H-2-BENZOPYRAN-4(3H)-ONE;ALPHA-ENDO-ADDUCT
Compound Number 18B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H30O3
InChI InChI=1S/C19H30O3/c1-3-4-5-6-7-13(2)22-19-18(20)17-15-10-8-14(9-11-15)16(17)12-21-19/h8,10,13-17,19H,3-7,9,11-12H2,1-2H3/t13-,14-,15+,16-,17+,19+/m0/s1
InChIKey QJNSYDZAUALDOU-AMQNGPJSSA-N
Literature Reference Author C.A.I.CAPACCIO,O.VARELA
Literature Reference Citation J.ORG.CHEM.,67,7839(2002)
Literature Reference DOI 10.1021/jo020309w
Molecular Weight 306.445 g/mol
Solvent CDCl3
Source File Reference UWSI22352