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[3-[4-(1,5-diphenylpenta-1,4-diyn-3-ylidene)-1-cyclohex-2-enylidene]-5-phenylpenta-1,4-diynyl]benzene
SpectraBase Compound ID 4XkCE9g11Ck
InChI InChI=1S/C40H26/c1-5-13-33(14-6-1)21-25-37(26-22-34-15-7-2-8-16-34)39-29-31-40(32-30-39)38(27-23-35-17-9-3-10-18-35)28-24-36-19-11-4-12-20-36/h1-20,29,31H,30,32H2
InChIKey FLUYCYBSXLRZCT-UHFFFAOYSA-N
Mol Weight 506.6 g/mol
Molecular Formula C40H26
Exact Mass 506.203451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6eCMko4addz
Name [3-[4-(1,5-diphenylpenta-1,4-diyn-3-ylidene)-1-cyclohex-2-enylidene]-5-phenylpenta-1,4-diynyl]benzene
Alternate Name(s) [3-[4-(1,5-diphenylpenta-1,4-diyn-3-ylidene)cyclohex-2-en-1-ylidene]-5-phenyl-penta-1,4-diynyl]benzene [5-phenyl-3-[4-[3-phenyl-1-(2-phenylethynyl)prop-2-ynylidene]cyclohex-2-en-1-ylidene]penta-1,4-diynyl]benzene
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Formula C40H26
InChI InChI=1S/C40H26/c1-5-13-33(14-6-1)21-25-37(26-22-34-15-7-2-8-16-34)39-29-31-40(32-30-39)38(27-23-35-17-9-3-10-18-35)28-24-36-19-11-4-12-20-36/h1-20,29,31H,30,32H2
InChIKey FLUYCYBSXLRZCT-UHFFFAOYSA-N
Molecular Weight 506.648 g/mol
SMILES C(C(C#Cc1ccccc1)=C1C=CC(=C(C#Cc2ccccc2)C#Cc2ccccc2)CC1)#Cc1ccccc1
SPLASH splash10-0a4i-0000090000-ab6d2d82ad02913130e4
Source of Spectrum U1-2002-1718-36
Wiley ID 1522567