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2-Chloro-5,11-dihydro-11-ethyl-8-formyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
SpectraBase Compound ID 6oUb7aDFojv
InChI InChI=1S/C14H11ClN4O2/c1-2-19-12-9(5-8(7-20)6-16-12)14(21)17-10-3-4-11(15)18-13(10)19/h3-7H,2H2,1H3,(H,17,21)
InChIKey HKCDLALXOGYBOL-UHFFFAOYSA-N
Mol Weight 302.72 g/mol
Molecular Formula C14H11ClN4O2
Exact Mass 302.057053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPVU4A9iEIM
Name 2-Chloro-5,11-dihydro-11-ethyl-8-formyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
Appearance Yellow solid
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Formula C14H11ClN4O2
InChI InChI=1S/C14H11ClN4O2/c1-2-19-12-9(5-8(7-20)6-16-12)14(21)17-10-3-4-11(15)18-13(10)19/h3-7H,2H2,1H3,(H,17,21)
InChIKey HKCDLALXOGYBOL-UHFFFAOYSA-N
Instrument Name Finnigan Polaris GCQ
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.5.36
Reported Formula C14H11ClN4O2
SMILES N1C(c2c(N(c3nc(ccc13)Cl)CC)ncc(c2)C=O)=O
SPLASH splash10-0fk9-0093000000-d41489a1c4fa4e03015c
Source of Spectrum BJO-5-SM9-21a
Wiley ID 1871605