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6'-Debromo-(trans)-3,4-dihydro-hamacanthin A
SpectraBase Compound ID 39HTbxcDqgo
InChI InChI=1S/C20H17BrN4O/c21-11-5-6-13-14(8-23-17(13)7-11)18-10-24-19(20(26)25-18)15-9-22-16-4-2-1-3-12(15)16/h1-9,18-19,22-24H,10H2,(H,25,26)
InChIKey ZUARLAYXSWWXPU-UHFFFAOYSA-N
Mol Weight 409.29 g/mol
Molecular Formula C20H17BrN4O
Exact Mass 408.058574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 161dsb0VeSo
Name 6'-Debromo-(trans)-3,4-dihydro-hamacanthin A
Alternate Name(s) 3-[6'-Bromoindol-3'-yl]-6-[indol-3''-yl)carbonyl]-(hexahydro)-1,4-pyrazine
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Formula C20H17BrN4O
InChI InChI=1S/C20H17BrN4O/c21-11-5-6-13-14(8-23-17(13)7-11)18-10-24-19(20(26)25-18)15-9-22-16-4-2-1-3-12(15)16/h1-9,18-19,22-24H,10H2,(H,25,26)
InChIKey ZUARLAYXSWWXPU-UHFFFAOYSA-N
Molecular Weight 409.287 g/mol
SMILES N1C(c2c[nH]c3c2ccc(c3)Br)CNC(C1=O)c1c[nH]c2c1cccc2
SPLASH splash10-00kb-0950000000-f0c326ceecf4eb51619b
Source of Spectrum G4-63-450-12
Wiley ID 1608323