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1H-[1]Benzoxepino[2,3,4-ij]isoquinolin-10-ol, 2,3,12,12a-tetrahydro-6,9-dimethoxy-1-methyl-, (.+-.)-
SpectraBase Compound ID BpJzoDmlfUM
InChI InChI=1S/C19H21NO4/c1-20-7-6-11-4-5-15(22-2)19-18(11)13(20)8-12-9-14(21)17(23-3)10-16(12)24-19/h4-5,9-10,13,21H,6-8H2,1-3H3
InChIKey AYHLVGRPZNWNGK-UHFFFAOYSA-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 FRgNySzmaTI
Name 1H-[1]Benzoxepino[2,3,4-ij]isoquinolin-10-ol, 2,3,12,12A-tetrahydro-6,9-dimethoxy-1-methyl-, (.+-.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 327.147058156 u
Formula C19H21NO4
InChI InChI=1S/C19H21NO4/c1-20-7-6-11-4-5-15(22-2)19-18(11)13(20)8-12-9-14(21)17(23-3)10-16(12)24-19/h4-5,9-10,13,21H,6-8H2,1-3H3
InChIKey AYHLVGRPZNWNGK-UHFFFAOYSA-N
Molecular Weight 327.380 g/mol
SMILES C=12C=3C(N(C)CCC3C=CC1OC)CC=1C(O2)=CC(=C(O)C1)OC