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3-[(3aR,5S,6R,6aR)-2,2,6-trimethyl-3a,5,6,6a-tetrahydrofuro[4,5-d][1,3]dioxol-5-yl]-3-(benzyloxymethyl)-2-methyl-5-phenyl-isoxazole

View entire compound with spectra: 1 NMR, and 2 MS (GC)

3-[(3aR,5S,6R,6aR)-2,2,6-trimethyl-3a,5,6,6a-tetrahydrofuro[4,5-d][1,3]dioxol-5-yl]-3-(benzyloxymethyl)-2-methyl-5-phenyl-isoxazole
SpectraBase Compound ID 8IM1QF2xhp8
InChI InChI=1S/C26H31NO5/c1-18-22-24(31-25(2,3)30-22)29-23(18)26(17-28-16-19-11-7-5-8-12-19)15-21(32-27(26)4)20-13-9-6-10-14-20/h5-15,18,22-24H,16-17H2,1-4H3/t18-,22+,23-,24+,26?/m0/s1
InChIKey KLAJICOUGLVKII-WYDRFEHLSA-N
Mol Weight 437.54 g/mol
Molecular Formula C26H31NO5
Exact Mass 437.220223 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 95oBpSqoRPk
Name 3-[(3aR,5S,6R,6aR)-2,2,6-trimethyl-3a,5,6,6a-tetrahydrofuro[4,5-d][1,3]dioxol-5-yl]-3-(benzyloxymethyl)-2-methyl-5-phenyl-isoxazole
Compound Number 19LA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H31NO5
InChI InChI=1S/C26H31NO5/c1-18-22-24(31-25(2,3)30-22)29-23(18)26(17-28-16-19-11-7-5-8-12-19)15-21(32-27(26)4)20-13-9-6-10-14-20/h5-15,18,22-24H,16-17H2,1-4H3/t18-,22+,23-,24+,26?/m0/s1
InChIKey KLAJICOUGLVKII-WYDRFEHLSA-N
Literature Reference Author S.TORRENTE,B.NOYA,V.BRANCHADELL,R.ALONSO
Literature Reference Citation J.ORG.CHEM.,68,4772(2003)
Literature Reference DOI 10.1021/jo034159g
Molecular Weight 437.536 g/mol
Solvent CDCl3
Source File Reference UWLU23866