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2-(4'-Heptyl[1,1'-biphenyl]-4-yl)-5-hexylpyrimidine

View entire compound with spectra: 3 MS (GC)

2-(4'-Heptyl[1,1'-biphenyl]-4-yl)-5-hexylpyrimidine
SpectraBase Compound ID DU9ukUZlEPC
InChI InChI=1S/C29H38N2/c1-3-5-7-9-11-12-24-14-16-26(17-15-24)27-18-20-28(21-19-27)29-30-22-25(23-31-29)13-10-8-6-4-2/h14-23H,3-13H2,1-2H3
InChIKey MBHGALQIQUJELF-UHFFFAOYSA-N
Mol Weight 414.6 g/mol
Molecular Formula C29H38N2
Exact Mass 414.303499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6QJbkclrST0
Name PYRIMIDINE, 2-(4'-HEPTYL[1,1'-BIPHENYL])-5-HEXYL-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H38N2
InChI InChI=1S/C29H38N2/c1-3-5-7-9-11-12-24-14-16-26(17-15-24)27-18-20-28(21-19-27)29-30-22-25(23-31-29)13-10-8-6-4-2/h14-23H,3-13H2,1-2H3
InChIKey MBHGALQIQUJELF-UHFFFAOYSA-N
Molecular Weight 414.3026
SMILES CCCCCCc1cnc(-c2ccc(-c3ccc(CCCCCCC)cc3)cc2)nc1
SPLASH splash10-06vl-6659600000-33d64affd923ca6b2c0b
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany