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1-[2-Bromo-3,4-(methylenedioxy)benzy])-6,7-(methylenedioxy)-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID EgjUPH4AFUK
InChI InChI=1S/C18H16BrNO4/c19-17-11(1-2-14-18(17)24-9-21-14)5-13-12-7-16-15(22-8-23-16)6-10(12)3-4-20-13/h1-2,6-7,13,20H,3-5,8-9H2
InChIKey QDGPBTYQKWWRCM-UHFFFAOYSA-N
Mol Weight 390.23 g/mol
Molecular Formula C18H16BrNO4
Exact Mass 389.026271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CeZ4Ko98As1
Name 1-[2-Bromo-3,4-(methylenedioxy)benzy])-6,7-(methylenedioxy)-1,2,3,4-tetrahydroisoquinoline
Alternate Name(s) 5-[(4-bromo-1,3-benzodioxol-5-yl)methyl]-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline 5-[(4-bromanyl-1,3-benzodioxol-5-yl)methyl]-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline
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Formula C18H16BrNO4
InChI InChI=1S/C18H16BrNO4/c19-17-11(1-2-14-18(17)24-9-21-14)5-13-12-7-16-15(22-8-23-16)6-10(12)3-4-20-13/h1-2,6-7,13,20H,3-5,8-9H2
InChIKey QDGPBTYQKWWRCM-UHFFFAOYSA-N
Molecular Weight 390.233 g/mol
SMILES N1CCc2cc3OCOc3cc2C1Cc1c(c2c(OCO2)cc1)Br
SPLASH splash10-004i-0900000000-9146c31777119b98ea82
Source of Spectrum J-64-6596-22
Wiley ID 1530950