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8-CHLORO-5,10,11,11A-TETRAHYDROPYRROLO-[2,1-C]-[1,4]-BENZODIAZEPIN-5,11-DIONE
SpectraBase Compound ID JNZOK71Bi33
InChI InChI=1S/C12H9ClN2O2/c13-7-3-4-8-9(6-7)14-11(16)10-2-1-5-15(10)12(8)17/h1,3-6,10H,2H2,(H,14,16)
InChIKey UBAISOFMZHBPAB-UHFFFAOYSA-N
Mol Weight 248.67 g/mol
Molecular Formula C12H9ClN2O2
Exact Mass 248.035255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DNjgt2h30Sg
Name 3-chloranyl-6a,7-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
Alternate Name(s) 3-chloro-6a,7-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione 3-chloro-6a,7-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-quinone
Comments Less than 3 mono-isotopic peaks
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Formula C12H9ClN2O2
InChI InChI=1S/C12H9ClN2O2/c13-7-3-4-8-9(6-7)14-11(16)10-2-1-5-15(10)12(8)17/h1,3-6,10H,2H2,(H,14,16)
InChIKey UBAISOFMZHBPAB-UHFFFAOYSA-N
Molecular Weight 248.669 g/mol
SMILES N1c2c(C(N3C(C1=O)CC=C3)=O)ccc(c2)Cl
SPLASH splash10-0002-0090000000-bd6c45fbbec25c15b6bd
Source of Spectrum H1-51-1265-24
Wiley ID 817117