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Methyl 6,8-dihydroxy-1-((p-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
SpectraBase Compound ID 6mkAYgOwGO8
InChI InChI=1S/C18H19NO5/c1-24-18(23)15-8-11-7-13(21)9-16(22)17(11)14(19-15)6-10-2-4-12(20)5-3-10/h2-5,7,9,14-15,19-22H,6,8H2,1H3
InChIKey RJSLTUAZCHXQSS-UHFFFAOYSA-N
Mol Weight 329.35 g/mol
Molecular Formula C18H19NO5
Exact Mass 329.126323 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L5VFfURxdbt
Name Methyl 6,8-dihydroxy-1-((p-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 329.126322711 u
Formula C18H19NO5
InChI InChI=1S/C18H19NO5/c1-24-18(23)15-8-11-7-13(21)9-16(22)17(11)14(19-15)6-10-2-4-12(20)5-3-10/h2-5,7,9,14-15,19-22H,6,8H2,1H3
InChIKey RJSLTUAZCHXQSS-UHFFFAOYSA-N
Molecular Weight 329.352 g/mol
SMILES C1(NC(CC=2C=C(C=C(C12)O)O)C(=O)OC)CC1=CC=C(C=C1)O