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4,2-cresotic acid, p-(hexyloxy)phenyl ester, p-butylbenzoate
SpectraBase Compound ID 1E3s9eJPV8I
InChI InChI=1S/C31H36O5/c1-4-6-8-9-21-34-26-15-17-27(18-16-26)35-31(33)29-20-19-28(22-23(29)3)36-30(32)25-13-11-24(12-14-25)10-7-5-2/h11-20,22H,4-10,21H2,1-3H3
InChIKey SWHQSVLGNOOYHZ-UHFFFAOYSA-N
Mol Weight 488.6 g/mol
Molecular Formula C31H36O5
Exact Mass 488.256274 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AaulkFK2SnG
Name 4,2-cresotic acid, p-(hexyloxy)phenyl ester, p-butylbenzoate
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Formula C31H36O5
InChI InChI=1S/C31H36O5/c1-4-6-8-9-21-34-26-15-17-27(18-16-26)35-31(33)29-20-19-28(22-23(29)3)36-30(32)25-13-11-24(12-14-25)10-7-5-2/h11-20,22H,4-10,21H2,1-3H3
InChIKey SWHQSVLGNOOYHZ-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 26035M
Solvent CDCl3