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(4-pentylphenyl) 4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate
SpectraBase Compound ID 6kRFn8h6jy0
InChI InChI=1S/C29H46O2/c1-3-5-7-9-23-11-15-25(16-12-23)26-17-19-27(20-18-26)29(30)31-28-21-13-24(14-22-28)10-8-6-4-2/h13-14,21-23,25-27H,3-12,15-20H2,1-2H3
InChIKey DPURCQCAESWWEL-UHFFFAOYSA-N
Mol Weight 426.7 g/mol
Molecular Formula C29H46O2
Exact Mass 426.349781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRItwL2Pd2N
Name [1,1'-BICYCLOHEXYL]-4-CARBOXYLIC ACID, 4'-PENTYL-, 4-PENTYLPHENYL ESTER
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Formula C29H46O2
InChI InChI=1S/C29H46O2/c1-3-5-7-9-23-11-15-25(16-12-23)26-17-19-27(20-18-26)29(30)31-28-21-13-24(14-22-28)10-8-6-4-2/h13-14,21-23,25-27H,3-12,15-20H2,1-2H3
InChIKey DPURCQCAESWWEL-UHFFFAOYSA-N
Molecular Weight 426.3486
SMILES CCCCCC1CCC(C2CCC(C(Oc3ccc(CCCCC)cc3)=O)CC2)CC1
SPLASH splash10-05ns-9510000000-10c3e21d80b9441c8b01
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany