For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3Z5Kdu5Ow4P
Name 2-(4'-Heptyl[1,1'-biphenyl]-4-yl)-5-hexylpyrimidine
CAS Registry Number 92519-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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 414.637 g/mol
SMILES C(C)CCCCc1cnc(nc1)-c1ccc(cc1)-c1ccc(cc1)CCCCCCC
SPLASH splash10-06vl-6659600000-33d64affd923ca6b2c0b
Synonyms 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-pyrimidine Pyrimidine, 2-(4'-heptyl[1,1'-biphenyl]-4-yl)-5-hexyl-
Wiley ID 1476015