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10-chloranyl-7-methyl-5H-[1,2,4]triazolo[4,3-d][1,4]benzodiazepin-6-one
SpectraBase Compound ID BRFiRLPMFD8
InChI InChI=1S/C11H9ClN4O/c1-15-9-3-2-7(12)4-8(9)11-14-13-6-16(11)5-10(15)17/h2-4,6H,5H2,1H3
InChIKey LDCGYDSZQSVAOV-UHFFFAOYSA-N
Mol Weight 248.67 g/mol
Molecular Formula C11H9ClN4O
Exact Mass 248.046489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Di1m8ro1J3K
Name 10-chloranyl-7-methyl-5H-[1,2,4]triazolo[4,3-d][1,4]benzodiazepin-6-one
CAS Registry Number 60726-49-0
Comments Less than 3 mono-isotopic peaks
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Formula C11H9ClN4O
InChI InChI=1S/C11H9ClN4O/c1-15-9-3-2-7(12)4-8(9)11-14-13-6-16(11)5-10(15)17/h2-4,6H,5H2,1H3
InChIKey LDCGYDSZQSVAOV-UHFFFAOYSA-N
Molecular Weight 248.673 g/mol
SMILES c12-c3[n](CC(N(c2ccc(c1)Cl)C)=O)cnn3
SPLASH splash10-00di-0090000000-1877ed5b78f161c28d57
Source of Spectrum J-44-95-0
Synonyms 10-chloro-7-methyl-5H-[1,2,4]triazolo[4,3-d][1,4]benzodiazepin-6-one
Wiley ID 1250587