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1-(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID HIT9plRf8l3
InChI InChI=1S/C23H26BrNO4/c1-5-10-29-23-18(24)11-16(13-21(23)26-4)22-17-14-20(28-7-3)19(27-6-2)12-15(17)8-9-25-22/h1,11-14,22,25H,6-10H2,2-4H3
InChIKey QGWLRKFYBIJAGV-UHFFFAOYSA-N
Mol Weight 460.37 g/mol
Molecular Formula C23H26BrNO4
Exact Mass 459.104521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBnvbeGbfFe
Name 1-(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline
Alternate Name(s) 1-(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline 1-(3-bromo-5-methoxy-4-propargyloxy-phenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline
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Formula C23H26BrNO4
InChI InChI=1S/C23H26BrNO4/c1-5-10-29-23-18(24)11-16(13-21(23)26-4)22-17-14-20(28-7-3)19(27-6-2)12-15(17)8-9-25-22/h1,11-14,22,25H,6-10H2,2-4H3
InChIKey QGWLRKFYBIJAGV-UHFFFAOYSA-N
Molecular Weight 460.368 g/mol
SMILES N1CCc2cc(c(cc2C1c1cc(Br)c(c(c1)OC)OCC#C)OCC)OCC
SPLASH splash10-074i-1451900000-f67f6370fc99d9e78359
Wiley ID 1464275