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(1A-R*)-(5A-S*)-(8A-R*)-(12A-S*)-(12B-R*)-12-B-(4-METHYL-PHENYL)-PERHYDRO-ISOINDOLO-[1,2-B]-PERHYDRO-[1,3]-BENZ-OXAZINE-8-ONE

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(1A-R*)-(5A-S*)-(8A-R*)-(12A-S*)-(12B-R*)-12-B-(4-METHYL-PHENYL)-PERHYDRO-ISOINDOLO-[1,2-B]-PERHYDRO-[1,3]-BENZ-OXAZINE-8-ONE
SpectraBase Compound ID LbYQLp2e2la
InChI InChI=1S/C22H27NO2/c1-13-6-8-15(9-7-13)22-20-17-11-10-16(17)19(20)21(24)23(22)12-14-4-2-3-5-18(14)25-22/h6-9,14,16-20H,2-5,10-12H2,1H3
InChIKey ITQADUSFEPGWMK-UHFFFAOYSA-N
Mol Weight 337.46 g/mol
Molecular Formula C22H27NO2
Exact Mass 337.204179 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BqFL7XNqYDs
Name (1A-R*)-(5A-S*)-(8A-R*)-(12A-S*)-(12B-R*)-12-B-(4-METHYL-PHENYL)-PERHYDRO-ISOINDOLO-[1,2-B]-PERHYDRO-[1,3]-BENZ-OXAZINE-8-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H27NO2
InChI InChI=1S/C22H27NO2/c1-13-6-8-15(9-7-13)22-20-17-11-10-16(17)19(20)21(24)23(22)12-14-4-2-3-5-18(14)25-22/h6-9,14,16-20H,2-5,10-12H2,1H3
InChIKey ITQADUSFEPGWMK-UHFFFAOYSA-N
Literature Reference Author P.SOHAR,G.STAJER,K.NAGY,G.BERNATH
Literature Reference Citation MAGN.RES.CHEM.,33,329(1995)
Literature Reference DOI 10.1002/mrc.1260330503
Molecular Weight 337.462 g/mol
Solvent CDCl3
Source File Reference UWRU1603