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(1R*,11bR*)-9,10-Dimethoxy-1-phenyl-1,6,7,11b-tetrahydro-2H,4H-1,3-oxazino[4,3-a]isoquinoline
SpectraBase Compound ID HcCKbOq3fBi
InChI InChI=1S/C20H23NO3/c1-22-18-10-15-8-9-21-13-24-12-17(14-6-4-3-5-7-14)20(21)16(15)11-19(18)23-2/h3-7,10-11,17,20H,8-9,12-13H2,1-2H3/t17-,20+/m1/s1
InChIKey KTCWNYLWBUDAPE-XLIONFOSSA-N
Mol Weight 325.41 g/mol
Molecular Formula C20H23NO3
Exact Mass 325.167794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4dFcZIo4OeL
Name (1R*,11Br*)-9,10-dimethoxy-1-phenyl-1,6,7,11B-tetrahydro-2H,4H-1,3-oxazino[4,3-A]isoquinoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 325.167793602 u
Formula C20H23NO3
InChI InChI=1S/C20H23NO3/c1-22-18-10-15-8-9-21-13-24-12-17(14-6-4-3-5-7-14)20(21)16(15)11-19(18)23-2/h3-7,10-11,17,20H,8-9,12-13H2,1-2H3/t17-,20+/m1/s1
InChIKey KTCWNYLWBUDAPE-XLIONFOSSA-N
Molecular Weight 325.408 g/mol
SMILES C1=2[C@@]3(N(COC[C@@]3(C=3C=CC=CC3)[H])CCC2C=C(C(=C1)OC)OC)[H]