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4-(1-{4-[(3-Methylbenzoyl)oxy]phenyl}cyclohexyl)phenyl 3-methylbenzoate

View entire compound with spectra: 2 NMR

4-(1-{4-[(3-Methylbenzoyl)oxy]phenyl}cyclohexyl)phenyl 3-methylbenzoate
SpectraBase Compound ID Fo0mSVbOS79
InChI InChI=1S/C34H32O4/c1-24-8-6-10-26(22-24)32(35)37-30-16-12-28(13-17-30)34(20-4-3-5-21-34)29-14-18-31(19-15-29)38-33(36)27-11-7-9-25(2)23-27/h6-19,22-23H,3-5,20-21H2,1-2H3
InChIKey BVUSVFQMIKNBRV-UHFFFAOYSA-N
Mol Weight 504.6 g/mol
Molecular Formula C34H32O4
Exact Mass 504.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CtZcWSlXEqa
Name 4-(1-{4-[(3-Methylbenzoyl)oxy]phenyl}cyclohexyl)phenyl 3-methylbenzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 504.230059506 u
Formula C34H32O4
InChI InChI=1S/C34H32O4/c1-24-8-6-10-26(22-24)32(35)37-30-16-12-28(13-17-30)34(20-4-3-5-21-34)29-14-18-31(19-15-29)38-33(36)27-11-7-9-25(2)23-27/h6-19,22-23H,3-5,20-21H2,1-2H3
InChIKey BVUSVFQMIKNBRV-UHFFFAOYSA-N
Molecular Weight 504.626 g/mol
SMILES C(C=1C=C(C)C=CC1)(OC1=CC=C(C2(C3=CC=C(OC(C=4C=C(C)C=CC4)=O)C=C3)CCCCC2)C=C1)=O