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Flustramin-B
SpectraBase Compound ID 8C8ut6TLtPN
InChI InChI=1S/C21H29BrN2/c1-15(2)8-10-21-11-13-23(5)20(21)24(12-9-16(3)4)19-14-17(22)6-7-18(19)21/h6-9,14,20H,10-13H2,1-5H3
InChIKey AXCACHVTDPCEAS-UHFFFAOYSA-N
Mol Weight 389.38 g/mol
Molecular Formula C21H29BrN2
Exact Mass 388.151412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xelQ0aCoh9
Name 6-Bromo-1-methyl-3a,8-bis(3-methyl-2-buten-1-yl)-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole Flustramine B
Alternate Name(s) 6-Bromo-1-methyl-3a,8-bis(3-methyl-2-butenyl)-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole
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Formula C21H29BrN2
InChI InChI=1S/C21H29BrN2/c1-15(2)8-10-21-11-13-23(5)20(21)24(12-9-16(3)4)19-14-17(22)6-7-18(19)21/h6-9,14,20H,10-13H2,1-5H3
InChIKey AXCACHVTDPCEAS-UHFFFAOYSA-N
Molecular Weight 389.381 g/mol
SMILES C12N(c3c(C2(CC=C(C)C)CCN1C)ccc(c3)Br)CC=C(C)C
SPLASH splash10-00xr-0009000000-c2186a67952fbac170ae
Source of Spectrum J-66-1192-2
Wiley ID 1534417