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1,4-Bis(3,4-dimethyl-5-formyl-2-pyrroyl)butadiyne
SpectraBase Compound ID L8eXSXMdvLT
InChI InChI=1S/C18H16N2O2/c1-11-13(3)17(9-21)19-15(11)7-5-6-8-16-12(2)14(4)18(10-22)20-16/h9-10,19-20H,1-4H3
InChIKey CLVHGULJTDFVLX-UHFFFAOYSA-N
Mol Weight 292.34 g/mol
Molecular Formula C18H16N2O2
Exact Mass 292.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DqpCeVoRKgv
Name 1,4-Bis(3,4-dimethyl-5-formyl-2-pyrroyl)butadiyne
Alternate Name(s) 5-[4-(5-formyl-3,4-dimethyl-1H-pyrrol-2-yl)buta-1,3-diynyl]-3,4-dimethyl-1H-pyrrole-2-carboxaldehyde 5-[4-(5-methanoyl-3,4-dimethyl-1H-pyrrol-2-yl)buta-1,3-diynyl]-3,4-dimethyl-1H-pyrrole-2-carbaldehyde
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Formula C18H16N2O2
InChI InChI=1S/C18H16N2O2/c1-11-13(3)17(9-21)19-15(11)7-5-6-8-16-12(2)14(4)18(10-22)20-16/h9-10,19-20H,1-4H3
InChIKey CLVHGULJTDFVLX-UHFFFAOYSA-N
Molecular Weight 292.338 g/mol
SMILES [nH]1c(c(c(c1C#CC#Cc1[nH]c(c(c1C)C)C=O)C)C)C=O
SPLASH splash10-0006-0290000000-c2ec1978d380cf7f424f
Source of Spectrum J-64-8049-5
Wiley ID 1531389