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Acetic acid (5S,5aS)-2,3-bromo-10-oxo-5a,6,7,8-tetrahydro-5H,10H-dipyrrolo[1,2-a;1',2'-d]pyrazin-5-yl ester
SpectraBase Compound ID 31wZlCX6xya
InChI InChI=1S/C12H12Br2N2O3/c1-6(17)19-12-8-3-2-4-15(8)11(18)9-5-7(13)10(14)16(9)12/h5,8,12H,2-4H2,1H3/t8-,12-/m0/s1
InChIKey MLNVWWCNUWCFAG-UFBFGSQYSA-N
Mol Weight 392.05 g/mol
Molecular Formula C12H12Br2N2O3
Exact Mass 389.921468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tdYAeyyUnD
Name Acetic acid (5S,5aS)-2,3-bromo-10-oxo-5a,6,7,8-tetrahydro-5H,10H-dipyrrolo[1,2-a;1',2'-d]pyrazin-5-yl ester
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Formula C12H12Br2N2O3
InChI InChI=1S/C12H12Br2N2O3/c1-6(17)19-12-8-3-2-4-15(8)11(18)9-5-7(13)10(14)16(9)12/h5,8,12H,2-4H2,1H3/t8-,12-/m0/s1
InChIKey MLNVWWCNUWCFAG-UFBFGSQYSA-N
Molecular Weight 392.047 g/mol
SMILES c12[n]([C@]([C@]3(N(C2=O)CCC3)[H])(OC(=O)C)[H])c(c(c1)Br)Br
SPLASH splash10-001i-0029000000-56f0c72f41b796165f7f
Source of Spectrum QF-10-1146-11
Synonyms (10S,10aS)-7,8-dibromo-5-oxo-2,3,10,10a-tetrahydro-1H,5H-dipyrrolo[1,2-a:1,2-d]pyrazin-10-yl acetate
Wiley ID 1559355