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(5aS,9aS,10aS)-2-Methyl-decahydropyrazino[1,2-a]indole-1,4-dione
SpectraBase Compound ID FZgae53MK8g
InChI InChI=1S/C12H18N2O2/c1-13-7-11(15)14-9-5-3-2-4-8(9)6-10(14)12(13)16/h8-10H,2-7H2,1H3/t8-,9-,10-/m1/s1
InChIKey JKIVEQBNQLFFPS-OPRDCNLKSA-N
Mol Weight 222.29 g/mol
Molecular Formula C12H18N2O2
Exact Mass 222.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ozCd29yDfg
Name (5aS,9aS,10aS)-2-Methyl-decahydropyrazino[1,2-a]indole-1,4-dione
Comments Removed - expert review: contamination (acetone))
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Formula C12H18N2O2
InChI InChI=1S/C12H18N2O2/c1-13-7-11(15)14-9-5-3-2-4-8(9)6-10(14)12(13)16/h8-10H,2-7H2,1H3/t8-,9-,10-/m1/s1
InChIKey JKIVEQBNQLFFPS-OPRDCNLKSA-N
Molecular Weight 222.288 g/mol
SMILES [C@]12(N(C(CN(C2=O)C)=O)[C@]2([C@@](C1)(CCCC2)[H])[H])[H]
SPLASH splash10-0006-9000000000-8d34557f121ad900b8f2
Source of Spectrum U1-2008-5424-21
Wiley ID 1662148