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4H-Benzo[a]quinolizin-4-one, 1,2,3,6,7,11b-hexahydro-2-(3-hydroxypropyl)-9,10-dimethoxy-, trans-(.+-.)-
SpectraBase Compound ID FZBiOtYnrOM
InChI InChI=1S/C18H25NO4/c1-22-16-10-13-5-6-19-15(14(13)11-17(16)23-2)8-12(4-3-7-20)9-18(19)21/h10-12,15,20H,3-9H2,1-2H3/t12-,15-/m1/s1
InChIKey KRBVIXZSXDLHFV-IUODEOHRSA-N
Mol Weight 319.4 g/mol
Molecular Formula C18H25NO4
Exact Mass 319.178358 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DaKTTt0eV8Y
Name 4H-Benzo[A]quinolizin-4-one, 1,2,3,6,7,11B-hexahydro-2-(3-hydroxypropyl)-9,10-dimethoxy-, trans-(.+-.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.178358285 u
Formula C18H25NO4
InChI InChI=1S/C18H25NO4/c1-22-16-10-13-5-6-19-15(14(13)11-17(16)23-2)8-12(4-3-7-20)9-18(19)21/h10-12,15,20H,3-9H2,1-2H3/t12-,15-/m1/s1
InChIKey KRBVIXZSXDLHFV-IUODEOHRSA-N
Molecular Weight 319.401 g/mol
SMILES [C@]12(N(CCC3=CC(=C(C=C23)OC)OC)C(C[C@@](C1)(CCCO)[H])=O)[H]