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5-(4-chlorophenyl)-3a,4-dihydro-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-1-one
SpectraBase Compound ID DCEfE3LkED0
InChI InChI=1S/C16H11ClN4O/c17-11-7-5-10(6-8-11)13-9-15-19-20-16(22)21(15)14-4-2-1-3-12(14)18-13/h1-8,15H,9H2
InChIKey AOWIFVWGWOLYMJ-UHFFFAOYSA-N
Mol Weight 310.74 g/mol
Molecular Formula C16H11ClN4O
Exact Mass 310.062139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID VSrDvpun4P
Name 5-(4-chlorophenyl)-3a,4-dihydro-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H11ClN4O
InChI InChI=1S/C16H11ClN4O/c17-11-7-5-10(6-8-11)13-9-15-19-20-16(22)21(15)14-4-2-1-3-12(14)18-13/h1-8,15H,9H2
InChIKey AOWIFVWGWOLYMJ-UHFFFAOYSA-N
Molecular Weight 310.744 g/mol
SMILES C12N(C(N=N2)=O)c2c(N=C(C1)c1ccc(cc1)Cl)cccc2
SPLASH splash10-03di-0019000000-ce8d089db2e3ebc35348
Source of Spectrum Y-28-367-0
Wiley ID 1311348