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2-Chloro-5,11-dihydro-11-ethyl-8-hydroxymethyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
SpectraBase Compound ID H0csRAJlreF
InChI InChI=1S/C14H13ClN4O2/c1-2-19-12-9(5-8(7-20)6-16-12)14(21)17-10-3-4-11(15)18-13(10)19/h3-6,20H,2,7H2,1H3,(H,17,21)
InChIKey SZKDIKJNTVNJTO-UHFFFAOYSA-N
Mol Weight 304.74 g/mol
Molecular Formula C14H13ClN4O2
Exact Mass 304.072703 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IfZtYdTZiUI
Name 2-Chloro-5,11-dihydro-11-ethyl-8-hydroxymethyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
Appearance White solid
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Formula C14H13ClN4O2
InChI InChI=1S/C14H13ClN4O2/c1-2-19-12-9(5-8(7-20)6-16-12)14(21)17-10-3-4-11(15)18-13(10)19/h3-6,20H,2,7H2,1H3,(H,17,21)
InChIKey SZKDIKJNTVNJTO-UHFFFAOYSA-N
Instrument Name Finnigan Polaris GCQ
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.5.36
Molecular Weight 304.737 g/mol
Reported Formula C14H13ClN4O2
SMILES N1C(c2c(ncc(CO)c2)N(c2c1ccc(Cl)n2)CC)=O
SPLASH splash10-0h00-0193000000-3e5cad291897a88a1c99
Source of Spectrum BJO-5-SM10-22a
Wiley ID 1871607