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8-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-7-hydroxy-oct-2-ynoic acid methyl ester
SpectraBase Compound ID Eim6k6WyApo
InChI InChI=1S/C20H25NO5/c1-24-18-11-14-9-10-21-17(16(14)13-19(18)25-2)12-15(22)7-5-4-6-8-20(23)26-3/h11,13,15,22H,4-5,7,9-10,12H2,1-3H3
InChIKey QZZYGWVZIZXKOY-UHFFFAOYSA-N
Mol Weight 359.42 g/mol
Molecular Formula C20H25NO5
Exact Mass 359.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID eOQMpNv37e
Name Methyl 7-hydroxy-8-(6,7-dimethoxy-3,4-dihydroxyisoquinoln-1-yl)oct-2-ynoate
Alternate Name(s) 8-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-7-hydroxy-2-octynoic acid methyl ester Methyl 8-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-7-hydroxyoct-2-ynoate Methyl 8-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-7-hydroxy-oct-2-ynoate Methyl 8-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-7-oxidanyl-oct-2-ynoate
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Formula C20H25NO5
InChI InChI=1S/C20H25NO5/c1-24-18-11-14-9-10-21-17(16(14)13-19(18)25-2)12-15(22)7-5-4-6-8-20(23)26-3/h11,13,15,22H,4-5,7,9-10,12H2,1-3H3
InChIKey QZZYGWVZIZXKOY-UHFFFAOYSA-N
Molecular Weight 359.422 g/mol
SMILES OC(CC=1c2cc(OC)c(cc2CCN1)OC)CCCC#CC(=O)OC
SPLASH splash10-000x-0294000000-4c75a976e0becbf5c89a
Source of Spectrum KC-57-1774-8
Wiley ID 1623020