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6-Phenylethynyl-3,4-dihydro-2H-pyridine-1-carboxylic Acid tert- Butyl Ester
SpectraBase Compound ID 2N4JW6pJQXR
InChI InChI=1S/C18H21NO2/c1-18(2,3)21-17(20)19-14-8-7-11-16(19)13-12-15-9-5-4-6-10-15/h4-6,9-11H,7-8,14H2,1-3H3
InChIKey DVNJBDJICNVEAS-UHFFFAOYSA-N
Mol Weight 283.37 g/mol
Molecular Formula C18H21NO2
Exact Mass 283.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnHv8LuK5j3
Name 6-Phenylethynyl-3,4-dihydro-2H-pyridine-1-carboxylic Acid tert- Butyl Ester
Alternate Name(s) tert-Butyl 6-(phenylethynyl)-3,4-dihydropyridine-1(2H)-carboxylate
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Formula C18H21NO2
InChI InChI=1S/C18H21NO2/c1-18(2,3)21-17(20)19-14-8-7-11-16(19)13-12-15-9-5-4-6-10-15/h4-6,9-11H,7-8,14H2,1-3H3
InChIKey DVNJBDJICNVEAS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo4019914
Molecular Weight 283.371 g/mol
SMILES C(C)(C)(OC(N1CCCC=C1C#Cc1ccccc1)=O)C
SPLASH splash10-0a9r-8960000000-39ac4b5e391b016e39b9
Source of Spectrum J-78-11011-1c
Wiley ID 1747316