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2-Chloro-5,11-dihydro-11-ethyl-4-methyl-8-vinyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
SpectraBase Compound ID LsmWbXOpHll
InChI InChI=1S/C16H15ClN4O/c1-4-10-7-11-14(18-8-10)21(5-2)15-13(20-16(11)22)9(3)6-12(17)19-15/h4,6-8H,1,5H2,2-3H3,(H,20,22)
InChIKey CVJARLQXZYTHMK-UHFFFAOYSA-N
Mol Weight 314.78 g/mol
Molecular Formula C16H15ClN4O
Exact Mass 314.093439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DAQWQz9CK4p
Name 2-Chloro-5,11-dihydro-11-ethyl-4-methyl-8-vinyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
Appearance Pale brown solid
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Formula C16H15ClN4O
InChI InChI=1S/C16H15ClN4O/c1-4-10-7-11-14(18-8-10)21(5-2)15-13(20-16(11)22)9(3)6-12(17)19-15/h4,6-8H,1,5H2,2-3H3,(H,20,22)
InChIKey CVJARLQXZYTHMK-UHFFFAOYSA-N
Instrument Name Finnigan Polaris GCQ
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.5.36
Reported Formula C16H15N4OCl
SMILES N1C(c2c(N(c3nc(cc(c13)C)Cl)CC)ncc(c2)C=C)=O
SPLASH splash10-03dr-0095000000-ec22f2c4d3e9ffbacd58
Source of Spectrum BJO-5-SM9-20b
Wiley ID 1871604