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1-Methyl-6-[6-[6-[6-[6-(6-methyl-1-cyclohepta-1,3,5-trienyl)-1-cyclohepta-1,3,5-trienyl]-1-cyclohepta-1,3,5-trienyl]-1-cyclohepta-1,3,5-trienyl]-1-cyclohepta-1,3,5-trienyl]cyclohepta-1,3,5-triene
SpectraBase Compound ID 8jb2cVNtq4
InChI InChI=1S/C44H42/c1-33-15-3-5-17-35(27-33)37-19-7-9-21-39(29-37)41-23-11-13-25-43(31-41)44-26-14-12-24-42(32-44)40-22-10-8-20-38(30-40)36-18-6-4-16-34(2)28-36/h3-26H,27-32H2,1-2H3
InChIKey MQJDVVYKACKPLS-UHFFFAOYSA-N
Mol Weight 570.8 g/mol
Molecular Formula C44H42
Exact Mass 570.328651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UsUKcchomL
Name 1-Methyl-6-[6-[6-[6-[6-(6-methyl-1-cyclohepta-1,3,5-trienyl)-1-cyclohepta-1,3,5-trienyl]-1-cyclohepta-1,3,5-trienyl]-1-cyclohepta-1,3,5-trienyl]-1-cyclohepta-1,3,5-trienyl]cyclohepta-1,3,5-triene
Alternate Name(s) 1-Methyl-6-[6-[6-[6-[6-(6-methylcyclohepta-1,3,5-trien-1-yl)cyclohepta-1,3,5-trien-1-yl]cyclohepta-1,3,5-trien-1-yl]cyclohepta-1,3,5-trien-1-yl]cyclohepta-1,3,5-trien-1-yl]cyclohepta-1,3,5-triene Bis(1,3,5-cycloheptatrien-1,1'-yl), 6,6'-bis[6-(6-methyl-1,3,5-cycloheptatrien-1-yl)-1,3,5-cycloheptatrien-1-yl]-
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Formula C44H42
InChI InChI=1S/C44H42/c1-33-15-3-5-17-35(27-33)37-19-7-9-21-39(29-37)41-23-11-13-25-43(31-41)44-26-14-12-24-42(32-44)40-22-10-8-20-38(30-40)36-18-6-4-16-34(2)28-36/h3-26H,27-32H2,1-2H3
InChIKey MQJDVVYKACKPLS-UHFFFAOYSA-N
Molecular Weight 570.820 g/mol
SMILES CC1=CC=CC=C(C1)C1=CC=CC=C(C1)C1=CC=CC=C(C1)C1=CC=CC=C(C1)C1=CC=CC=C(C1)C1=CC=CC=C(C1)C
SPLASH splash10-0100-1973020000-0adb2033bcf807bbced0
Wiley ID 1498036