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1,2,3,4,5,6-hexakis(3,3-dimethylbutyl)benzene

View entire compound with spectra: 1 MS (GC)

1,2,3,4,5,6-hexakis(3,3-dimethylbutyl)benzene
SpectraBase Compound ID DGkrUvxFkfd
InChI InChI=1S/C42H78/c1-37(2,3)25-19-31-32(20-26-38(4,5)6)34(22-28-40(10,11)12)36(24-30-42(16,17)18)35(23-29-41(13,14)15)33(31)21-27-39(7,8)9/h19-30H2,1-18H3
InChIKey KBZWDSKXBWKWEE-UHFFFAOYSA-N
Mol Weight 583.1 g/mol
Molecular Formula C42H78
Exact Mass 582.610353 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8e4Ya0QsUVP
Name 1,2,3,4,5,6-hexakis(3,3-dimethylbutyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H78
InChI InChI=1S/C42H78/c1-37(2,3)25-19-31-32(20-26-38(4,5)6)34(22-28-40(10,11)12)36(24-30-42(16,17)18)35(23-29-41(13,14)15)33(31)21-27-39(7,8)9/h19-30H2,1-18H3
InChIKey KBZWDSKXBWKWEE-UHFFFAOYSA-N
Molecular Weight 583.086 g/mol
SMILES c1(c(c(c(c(c1CCC(C)(C)C)CCC(C)(C)C)CCC(C)(C)C)CCC(C)(C)C)CCC(C)(C)C)CCC(C)(C)C
SPLASH splash10-001i-1000090000-2ec69a6effd962dd362a
Source of Spectrum QE-11-318-23
Wiley ID 1586508