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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

View entire compound with spectra: 2 MS (GC)

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 Ja5c9Qw533e
Name BIS(1,3,5-CYCLOHEPTATRIEN-1,1'-YL), 6,6'-BIS[6-(6-METHYL-1,3,5-CYCLOHEPTATRIEN-1-YL)]-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
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
Instrument Name 311A
Molecular Weight 570.3276
SMILES C=1(C)CC(C=2CC(C=3CC(C=4CC(C=5CC(C=6CC(C)=CC=CC6)=CC=CC5)=CC=CC4)=CC=CC3)=CC=CC2)=CC=CC1
SPLASH splash10-0100-1973020000-d9407ac2733ecfa3e671
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany