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(4'-Methoxy-[1,1'-biphenyl]-4-yl 4-(4-pentylcyclohexyl)benzoate)
SpectraBase Compound ID 6Lqt660XRkL
InChI InChI=1S/C31H36O3/c1-3-4-5-6-23-7-9-24(10-8-23)25-11-13-28(14-12-25)31(32)34-30-21-17-27(18-22-30)26-15-19-29(33-2)20-16-26/h11-24H,3-10H2,1-2H3
InChIKey SNUKCWQRPXEHHA-UHFFFAOYSA-N
Mol Weight 456.6 g/mol
Molecular Formula C31H36O3
Exact Mass 456.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9EfWh8ibtvv
Name (4'-Methoxy-[1,1'-biphenyl]-4-yl 4-(4-pentylcyclohexyl)benzoate)
Appearance White solid
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Formula C31H36O3
InChI InChI=1S/C31H36O3/c1-3-4-5-6-23-7-9-24(10-8-23)25-11-13-28(14-12-25)31(32)34-30-21-17-27(18-22-30)26-15-19-29(33-2)20-16-26/h11-24H,3-10H2,1-2H3
InChIKey SNUKCWQRPXEHHA-UHFFFAOYSA-N
Instrument Name Agilent 7890B-5977A
Ionization Type EI
Molecular Weight 456.626 g/mol
SMILES c1cc(ccc1-c1ccc(cc1)OC)OC(c1ccc(cc1)C1CCC(CC1)CCCCC)=O
SPLASH splash10-0a4i-2970000000-d17be0110b0d666a5055
Source of Spectrum CN114805121A
Wiley ID 1884608