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10-Bromo-2,3-dimethoxy-5,6,8,12-tetrahydro-13aH-thieno[2',3':5,6][1,3]oxazepino[2,3-a]isoquinoline
SpectraBase Compound ID BkkgZGJrve0
InChI InChI=1S/C17H18BrNO3S/c1-20-13-5-10-3-4-19-8-15-11(6-16(18)23-15)9-22-17(19)12(10)7-14(13)21-2/h5-7,17H,3-4,8-9H2,1-2H3
InChIKey NNROXNWWOLGGTL-UHFFFAOYSA-N
Mol Weight 396.3 g/mol
Molecular Formula C17H18BrNO3S
Exact Mass 395.019078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID axJz5V1lTJ
Name 10-Bromo-2,3-dimethoxy-5,6,8,12-tetrahydro-13aH-thieno[2',3':5,6][1,3]oxazepino[2,3-a]isoquinoline
Alternate Name(s) 10-bromo-2,3-dimethoxy-5,8,12,13a-tetrahydro-6H-thieno[2',3':5,6][1,3]oxazepino[2,3-a]isoquinoline
Comments Less than 3 mono-isotopic peaks
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Formula C17H18BrNO3S
InChI InChI=1S/C17H18BrNO3S/c1-20-13-5-10-3-4-19-8-15-11(6-16(18)23-15)9-22-17(19)12(10)7-14(13)21-2/h5-7,17H,3-4,8-9H2,1-2H3
InChIKey NNROXNWWOLGGTL-UHFFFAOYSA-N
Molecular Weight 396.299 g/mol
SMILES C12N(Cc3sc(cc3CO2)Br)CCc2c1cc(c(OC)c2)OC
SPLASH splash10-0002-0009000000-ecfb197a84bc48e57df7
Source of Spectrum SO-0-1022-7
Wiley ID 1537486