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(cis)-3,4-dihydro-hamacanthin A
SpectraBase Compound ID 6OIvUCf2plC
InChI InChI=1S/C20H16Br2N4O/c21-10-1-3-12-14(7-23-16(12)5-10)18-9-25-19(20(27)26-18)15-8-24-17-6-11(22)2-4-13(15)17/h1-8,18-19,23-25H,9H2,(H,26,27)
InChIKey WQWGKDGEXNWWHH-UHFFFAOYSA-N
Mol Weight 488.18 g/mol
Molecular Formula C20H16Br2N4O
Exact Mass 485.969087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3vYQOZtDea
Name (cis)-3,4-dihydro-hamacanthin A
Alternate Name(s) (trans)-3,4-dihydro-hamacanthin A 3,6-bis(6-bromo-1H-indol-3-yl)-2-piperazinone 3,6-bis[6'-Bromoindol-3'-yl]-(hexahydro)-1,4-pyrazin-2-one
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Formula C20H16Br2N4O
InChI InChI=1S/C20H16Br2N4O/c21-10-1-3-12-14(7-23-16(12)5-10)18-9-25-19(20(27)26-18)15-8-24-17-6-11(22)2-4-13(15)17/h1-8,18-19,23-25H,9H2,(H,26,27)
InChIKey WQWGKDGEXNWWHH-UHFFFAOYSA-N
Molecular Weight 488.183 g/mol
SMILES N1C(c2c[nH]c3c2ccc(c3)Br)CNC(C1=O)c1c[nH]c2c1ccc(c2)Br
SPLASH splash10-0005-0980100000-73bb08f4268a65ed9dad
Source of Spectrum G4-63-450-10
Wiley ID 1608325