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Thebaine N-oxide

View entire compound with spectra: 1 NMR

Thebaine N-oxide
SpectraBase Compound ID CJ3mB5MATrM
InChI InChI=1S/C19H21NO4/c1-20(21)9-8-19-12-5-7-15(23-3)18(19)24-17-14(22-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3/t13-,18?,19+,20-/m0/s1
InChIKey PMXUJDPQAVEYII-JETBPIFZSA-N
Mol Weight 327.38 g/mol
Molecular Formula C19H21NO4
Exact Mass 327.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9IemvWbfjHp
Name THEBAINE-N-OXIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21NO4
InChI InChI=1S/C19H21NO4/c1-20(21)9-8-19-12-5-7-15(23-3)18(19)24-17-14(22-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3/t13-,18?,19+,20-/m0/s1
InChIKey PMXUJDPQAVEYII-JETBPIFZSA-N
Literature Reference Author G.W.CALDWELL,A.D.GAUTHIER,J.E.MILLS
Literature Reference Citation MAGN.RES.CHEM.,34,505(1996)
Literature Reference DOI 10.1002/(sici)1097-458x(199607)34:7<505::aid-omr913>3.0.co;2-y
Molecular Weight 327.380 g/mol
Solvent CDCl3
Source File Reference UWRK3821