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5-(2-bromo-3,4-dimethoxy-benzyl)-5,6,7,8-tetrahydro-[1,3]dioxol[4,5-g]isoquinoline
SpectraBase Compound ID IbUscEwqZGl
InChI InChI=1S/C19H20BrNO4/c1-22-15-4-3-12(18(20)19(15)23-2)7-14-13-9-17-16(24-10-25-17)8-11(13)5-6-21-14/h3-4,8-9,14,21H,5-7,10H2,1-2H3
InChIKey HCUQVCMAURLYBS-UHFFFAOYSA-N
Mol Weight 406.28 g/mol
Molecular Formula C19H20BrNO4
Exact Mass 405.057571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IwdoSmez3kw
Name 5-(2-bromo-3,4-dimethoxy-benzyl)-5,6,7,8-tetrahydro-[1,3]dioxol[4,5-g]isoquinoline
Alternate Name(s) 5-[(2-bromanyl-3,4-dimethoxy-phenyl)methyl]-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline 5-[(2-bromo-3,4-dimethoxy-phenyl)methyl]-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline
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Formula C19H20BrNO4
InChI InChI=1S/C19H20BrNO4/c1-22-15-4-3-12(18(20)19(15)23-2)7-14-13-9-17-16(24-10-25-17)8-11(13)5-6-21-14/h3-4,8-9,14,21H,5-7,10H2,1-2H3
InChIKey HCUQVCMAURLYBS-UHFFFAOYSA-N
Molecular Weight 406.276 g/mol
SMILES N1CCc2c(C1Cc1c(c(c(cc1)OC)OC)Br)cc1c(c2)OCO1
SPLASH splash10-004i-0900000000-b4a6a0908e07a3a094ce
Source of Spectrum J-64-6596-22
Wiley ID 1530951