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[1-(2,4-diphenylbutyl)-5-methyl-3-phenyl-heptyl]benzene
SpectraBase Compound ID 1S976fZA3ei
InChI InChI=1S/C36H42/c1-3-29(2)26-35(32-20-12-6-13-21-32)28-36(33-22-14-7-15-23-33)27-34(31-18-10-5-11-19-31)25-24-30-16-8-4-9-17-30/h4-23,29,34-36H,3,24-28H2,1-2H3
InChIKey SLRAWFHUHRKSET-UHFFFAOYSA-N
Mol Weight 474.7 g/mol
Molecular Formula C36H42
Exact Mass 474.328651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 89tnFPca2Ls
Name [1-(2,4-diphenylbutyl)-5-methyl-3-phenyl-heptyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H42
InChI InChI=1S/C36H42/c1-3-29(2)26-35(32-20-12-6-13-21-32)28-36(33-22-14-7-15-23-33)27-34(31-18-10-5-11-19-31)25-24-30-16-8-4-9-17-30/h4-23,29,34-36H,3,24-28H2,1-2H3
InChIKey SLRAWFHUHRKSET-UHFFFAOYSA-N
Instrument Name Agilent Model 7820A-5977B
Ionization Type EI
Literature Reference DOI 10.1002/cssc.202102317
Molecular Weight 474.732 g/mol
SMILES c1cccc(c1)C(CC(C)CC)CC(CC(c1ccccc1)CCc1ccccc1)c1ccccc1
SPLASH splash10-0006-7900000000-655043afc0dfdd57503b
Source of Spectrum CSC-15-SM53-Figure S46-e
Wiley ID 1873427