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(5S,6S)-10,12-Diaza-6-hydroxy-10,12-dimethyltricyclo[6.4.0.0(1,5)]dodeca-3,7-dien-9,11-dione 2,2,2,trifluoroacetate
SpectraBase Compound ID LEXpkExUhAW
InChI InChI=1S/C12H14N2O3/c1-13-10(16)8-6-9(15)7-4-3-5-12(7,8)14(2)11(13)17/h3-4,6-7,9,15H,5H2,1-2H3/t7-,9+,12?/m1/s1
InChIKey GLEIMLXEZFRKAV-ZYKPYLKRSA-N
Mol Weight 234.25 g/mol
Molecular Formula C12H14N2O3
Exact Mass 234.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64kgYOHw31b
Name (5S,6S)-10,12-Diaza-6-hydroxy-10,12-dimethyltricyclo[6.4.0.0(1,5)]dodeca-3,7-dien-9,11-dione 2,2,2,trifluoroacetate
Alternate Name(s) (3aS,4S)-4-Hydroxy-7,9-dimethyl-3a,4-dihydro-1H-7,9-diaza-cyclopenta[c]indene-6,8-dione (6S,6aS)-6-hydroxy-1,3-dimethyl-6a,9-dihydro-1H-pentaleno[6a,1-d]pyrimidine-2,4(3H,6H)-dione 10,12-Diaza-6-hydroxy-10,12-dimethyltricyclo[6.4.0.0(1,5)]dodeca-3,7-dien-9,11-dione 2,2,2,trifluoroacetate
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Formula C12H14N2O3
InChI InChI=1S/C12H14N2O3/c1-13-10(16)8-6-9(15)7-4-3-5-12(7,8)14(2)11(13)17/h3-4,6-7,9,15H,5H2,1-2H3/t7-,9+,12?/m1/s1
InChIKey GLEIMLXEZFRKAV-ZYKPYLKRSA-N
Molecular Weight 234.255 g/mol
SMILES O[C@]1(C=C2C3(N(C)C(N(C2=O)C)=O)[C@@]1(C=CC3)[H])[H]
SPLASH splash10-0a59-0090000000-290ac285bb2d8c1b7dec
Source of Spectrum H1-49-62-7
Wiley ID 816731