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1-(p-Nitrophenyl)-dodeca-1,3-diyne
SpectraBase Compound ID 65zFqYkG5XB
InChI InChI=1S/C18H21NO2/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)19(20)21/h13-16H,2-8H2,1H3
InChIKey BGSOOMMBDNTKFK-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 HyVRyZrRuvT
Name 1-(p-Nitrophenyl)-dodeca-1,3-diyne
Alternate Name(s) 1-(1,3-dodecadiynyl)-4-nitrobenzene
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Formula C18H21NO2
InChI InChI=1S/C18H21NO2/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)19(20)21/h13-16H,2-8H2,1H3
InChIKey BGSOOMMBDNTKFK-UHFFFAOYSA-N
Molecular Weight 283.371 g/mol
SMILES C(#CC#CCCCCCCCC)c1ccc(cc1)N(=O)=O
SPLASH splash10-0fvi-0940000000-8ef126a43c433d8df945
Source of Spectrum H-2005-886-27
Wiley ID 1562431