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2-Chloro-5,11-dihydro-11-ethyl-8-chloromethyl-4-methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
SpectraBase Compound ID ESLmNf17CnF
InChI InChI=1S/C15H14Cl2N4O/c1-3-21-13-10(5-9(6-16)7-18-13)15(22)20-12-8(2)4-11(17)19-14(12)21/h4-5,7H,3,6H2,1-2H3,(H,20,22)
InChIKey HFNVWWYVOLEJJF-UHFFFAOYSA-N
Mol Weight 337.21 g/mol
Molecular Formula C15H14Cl2N4O
Exact Mass 336.054466 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBFYjpovY6K
Name 2-Chloro-5,11-dihydro-11-ethyl-8-chloromethyl-4-methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
Appearance White solid
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Formula C15H14Cl2N4O
InChI InChI=1S/C15H14Cl2N4O/c1-3-21-13-10(5-9(6-16)7-18-13)15(22)20-12-8(2)4-11(17)19-14(12)21/h4-5,7H,3,6H2,1-2H3,(H,20,22)
InChIKey HFNVWWYVOLEJJF-UHFFFAOYSA-N
Instrument Name Finnigan Polaris GCQ
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.5.36
Molecular Weight 337.210 g/mol
Reported Formula C15H14N4OCl2
SMILES N1C(c2c(N(c3nc(cc(c13)C)Cl)CC)ncc(c2)CCl)=O
SPLASH splash10-05g0-0059000000-2758ee114f05ac179775
Source of Spectrum BJO-5-SM12-23b
Wiley ID 1871610