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10,12B-DIPHENYL-3,6-METHANO-2A,3,6,6A,8A,9,10,11,12,12A-DECAHYDROISOINDOLO-[2,1-A]-[3,1]-BENZOXAZIN-8-ONE
SpectraBase Compound ID 6svU40DTqES
InChI InChI=1S/C28H29NO2/c30-27-23-16-19(18-7-3-1-4-8-18)13-14-25(23)28(22-9-5-2-6-10-22)29(27)26-21-12-11-20(15-21)24(26)17-31-28/h1-12,19-21,23-26H,13-17H2/t19-,20-,21+,23+,24+,25-,26-,28-/m1/s1
InChIKey OQMLWUIPYOOBTN-VOJNHXGDSA-N
Mol Weight 411.55 g/mol
Molecular Formula C28H29NO2
Exact Mass 411.219829 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 96shrrPSonB
Name 10,12B-DIPHENYL-3,6-METHANO-2A,3,6,6A,8A,9,10,11,12,12A-DECAHYDROISOINDOLO-[2,1-A]-[3,1]-BENZOXAZIN-8-ONE
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H29NO2
InChI InChI=1S/C28H29NO2/c30-27-23-16-19(18-7-3-1-4-8-18)13-14-25(23)28(22-9-5-2-6-10-22)29(27)26-21-12-11-20(15-21)24(26)17-31-28/h1-12,19-21,23-26H,13-17H2/t19-,20-,21+,23+,24+,25-,26-,28-/m1/s1
InChIKey OQMLWUIPYOOBTN-VOJNHXGDSA-N
Literature Reference Author G.STAJER,A.E.SZABO,G.BERNATH,P.SOHAR
Literature Reference Citation HETEROCYCLES,38,1061(1994)
Literature Reference DOI 10.3987/COM-93-6660
Molecular Weight 411.544 g/mol
Solvent CDCl3
Source File Reference UWRK3569