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(1R,2S,3R,4S)-(4"-Methylbenzoyl)-1-(p-methylphenyl)-3,4-phenyl-cyclopentanol

View entire compound with spectra: 1 MS (GC)

(1R,2S,3R,4S)-(4"-Methylbenzoyl)-1-(p-methylphenyl)-3,4-phenyl-cyclopentanol
SpectraBase Compound ID G6gOhe6JzFx
InChI InChI=1S/C32H30O2/c1-22-13-17-26(18-14-22)31(33)30-29(25-11-7-4-8-12-25)28(24-9-5-3-6-10-24)21-32(30,34)27-19-15-23(2)16-20-27/h3-20,28-30,34H,21H2,1-2H3/t28-,29-,30-,32+/m1/s1
InChIKey VKKBYCWRNXQULD-NLLMHJBRSA-N
Mol Weight 446.6 g/mol
Molecular Formula C32H30O2
Exact Mass 446.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2aLvaDclBOA
Name (1R,2S,3R,4S)-(4"-Methylbenzoyl)-1-(p-methylphenyl)-3,4-phenyl-cyclopentanol
Alternate Name(s) (1R,2S,3R,4S)-(4''-Methylbenzoyl)-1-(p-methylphenyl)-3,4-phenyl-cyclopentanol 2-(4''-Methylbenzoyl)-1-(p-methylphenyl)-3,4-phenyl-cyclopentanol 2-(4''-Methylbenzoyl)-1-(p-methylphenyl)-3,4-phenyl-cyclopentanol [(1S,2R,4S,5R)-2-hydroxy-2-(4-methylphenyl)-4,5-diphenylcyclopentyl](4-methylphenyl)methanone
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Formula C32H30O2
InChI InChI=1S/C32H30O2/c1-22-13-17-26(18-14-22)31(33)30-29(25-11-7-4-8-12-25)28(24-9-5-3-6-10-24)21-32(30,34)27-19-15-23(2)16-20-27/h3-20,28-30,34H,21H2,1-2H3/t28-,29-,30-,32+/m1/s1
InChIKey VKKBYCWRNXQULD-NLLMHJBRSA-N
Molecular Weight 446.590 g/mol
SMILES O[C@]1([C@]([C@@]([C@@](c2ccccc2)(C1)[H])(c1ccccc1)[H])(C(c1ccc(cc1)C)=O)[H])c1ccc(cc1)C
SPLASH splash10-00xr-2790000000-05b1b7aec818196d56e6
Source of Spectrum SK-30-604-2
Wiley ID 881159