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5-Nitro-2-[4-(4-phenyl)-3,6-dihydro-2H-pyridin-1-yl)-1-butynyl]pyridine
SpectraBase Compound ID 3j8qBGE0Myb
InChI InChI=1S/C20H19N3O2/c24-23(25)20-10-9-19(21-16-20)8-4-5-13-22-14-11-18(12-15-22)17-6-2-1-3-7-17/h1-3,6-7,9-11,16H,5,12-15H2
InChIKey AACKLOKIDNIXMK-UHFFFAOYSA-N
Mol Weight 333.39 g/mol
Molecular Formula C20H19N3O2
Exact Mass 333.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IyaOHJFS2KS
Name 5-Nitro-2-[4-(4-phenyl)-3,6-dihydro-2H-pyridin-1-yl)-1-butynyl]pyridine
Comments Less than 3 mono-isotopic peaks
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Formula C20H19N3O2
InChI InChI=1S/C20H19N3O2/c24-23(25)20-10-9-19(21-16-20)8-4-5-13-22-14-11-18(12-15-22)17-6-2-1-3-7-17/h1-3,6-7,9-11,16H,5,12-15H2
InChIKey AACKLOKIDNIXMK-UHFFFAOYSA-N
Molecular Weight 333.391 g/mol
SMILES c1(N(=O)=O)cnc(C#CCCN2CC=C(CC2)c2ccccc2)cc1
SPLASH splash10-00di-0900000000-8dde6938d95d13be6c2f
Source of Spectrum E1-39-3185-0
Wiley ID 1598858