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5,6-bis(hex-1-ynyl)isoindole-1,3-dione
SpectraBase Compound ID JwHyYvvTq55
InChI InChI=1S/C20H21NO2/c1-3-5-7-9-11-15-13-17-18(20(23)21-19(17)22)14-16(15)12-10-8-6-4-2/h13-14H,3-8H2,1-2H3,(H,21,22,23)
InChIKey XPOJIJLTMPSDJO-UHFFFAOYSA-N
Mol Weight 307.39 g/mol
Molecular Formula C20H21NO2
Exact Mass 307.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gnda3lFtQvY
Name 5,6-bis(hex-1-ynyl)isoindole-1,3-dione
Alternate Name(s) 5,6-bis(hex-1-ynyl)isoindoline-1,3-dione 5,6-bis(hex-1-ynyl)isoindoline-1,3-quinone
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Formula C20H21NO2
InChI InChI=1S/C20H21NO2/c1-3-5-7-9-11-15-13-17-18(20(23)21-19(17)22)14-16(15)12-10-8-6-4-2/h13-14H,3-8H2,1-2H3,(H,21,22,23)
InChIKey XPOJIJLTMPSDJO-UHFFFAOYSA-N
Molecular Weight 307.393 g/mol
SMILES N1C(c2cc(c(cc2C1=O)C#CCCCC)C#CCCCC)=O
SPLASH splash10-0k96-0859000000-23778c071e12ed1f0836
Source of Spectrum U1-2000-309-12
Wiley ID 753825