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2-[3(Z)-Undecen-1,5-diynyl]benzonitrile
SpectraBase Compound ID 7vnr4sgY1Ya
InChI InChI=1S/C18H17N/c1-2-3-4-5-6-7-8-9-10-13-17-14-11-12-15-18(17)16-19/h8-9,11-12,14-15H,2-5H2,1H3/b9-8-
InChIKey ZXVOYKYUXKGZQH-HJWRWDBZSA-N
Mol Weight 247.34 g/mol
Molecular Formula C18H17N
Exact Mass 247.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqHualWvCaD
Name 2-[3(Z)-Undecen-1,5-diynyl]benzonitrile
Alternate Name(s) 2-[(3Z)-3-undecene-1,5-diynyl]benzonitrile 2-[(Z)-undec-3-en-1,5-diynyl]benzenecarbonitrile
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Formula C18H17N
InChI InChI=1S/C18H17N/c1-2-3-4-5-6-7-8-9-10-13-17-14-11-12-15-18(17)16-19/h8-9,11-12,14-15H,2-5H2,1H3/b9-8-
InChIKey ZXVOYKYUXKGZQH-HJWRWDBZSA-N
Molecular Weight 247.341 g/mol
SMILES C(#Cc1c(C#N)cccc1)\C=C/C#CCCCCC
SPLASH splash10-0udl-0390000000-687b1f1de216aea7333e
Source of Spectrum J-67-5909-1
Wiley ID 1570639