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Thebaine

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

Thebaine
SpectraBase Compound ID IdASuqDIhre
InChI InChI=1S/C19H21NO3/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3/t13-,18?,19+/m0/s1
InChIKey FQXXSQDCDRQNQE-LPHKOSDUSA-N
Mol Weight 311.38 g/mol
Molecular Formula C19H21NO3
Exact Mass 311.152144 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JxR6pjQC2wD
Name THEBAINE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21NO3
InChI InChI=1S/C19H21NO3/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3/t13-,18?,19+/m0/s1
InChIKey FQXXSQDCDRQNQE-LPHKOSDUSA-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 311.381 g/mol
Solvent CDCl3
Source File Reference UWRK3814