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(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl 2,6-dimethoxybenzoate

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(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl 2,6-dimethoxybenzoate
SpectraBase Compound ID G6L0eTCblI1
InChI InChI=1S/C19H27NO4/c1-22-16-9-5-10-17(23-2)18(16)19(21)24-13-14-7-6-12-20-11-4-3-8-15(14)20/h5,9-10,14-15H,3-4,6-8,11-13H2,1-2H3/t14-,15+/m0/s1
InChIKey HRIOKQHKHYNGPD-LSDHHAIUSA-N
Mol Weight 333.43 g/mol
Molecular Formula C19H27NO4
Exact Mass 333.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K7Lsn3p9OqA
Name (1R,9ar)-Octahydro-2H-quinolizin-1-ylmethyl 2,6-dimethoxybenzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.194008349 u
Formula C19H27NO4
InChI InChI=1S/C19H27NO4/c1-22-16-9-5-10-17(23-2)18(16)19(21)24-13-14-7-6-12-20-11-4-3-8-15(14)20/h5,9-10,14-15H,3-4,6-8,11-13H2,1-2H3/t14-,15+/m0/s1
InChIKey HRIOKQHKHYNGPD-LSDHHAIUSA-N
Molecular Weight 333.428 g/mol
SMILES C1(C(OC[C@]2([C@@]3(N(CCCC3)CCC2)[H])[H])=O)=C(OC)C=CC=C1OC