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(1S,2R)/(1R,2S)-1-(4-Chlorophenyl)-3-(4-methylphenyl)-3-oxo-2-phenylpropyl Acetate
SpectraBase Compound ID 46A8uGgHfDA
InChI InChI=1S/C24H21ClO3/c1-16-8-10-19(11-9-16)23(27)22(18-6-4-3-5-7-18)24(28-17(2)26)20-12-14-21(25)15-13-20/h3-15,22,24H,1-2H3/t22-,24+/m0/s1
InChIKey LEPZTYMOHVVBOB-LADGPHEKSA-N
Mol Weight 392.88 g/mol
Molecular Formula C24H21ClO3
Exact Mass 392.117922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQ6SpdJi6ar
Name (1S,2R)/(1R,2S)-1-(4-Chlorophenyl)-3-(4-methylphenyl)-3-oxo-2-phenylpropyl Acetate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21ClO3
InChI InChI=1S/C24H21ClO3/c1-16-8-10-19(11-9-16)23(27)22(18-6-4-3-5-7-18)24(28-17(2)26)20-12-14-21(25)15-13-20/h3-15,22,24H,1-2H3/t22-,24+/m0/s1
InChIKey LEPZTYMOHVVBOB-LADGPHEKSA-N
Instrument Name Agilent Technologies (HP) 5973
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901647
Molecular Weight 392.882 g/mol
SMILES c1c([C@]([C@@](c2ccc(Cl)cc2)(OC(=O)C)[H])(C(=O)c2ccc(cc2)C)[H])cccc1
SPLASH splash10-03xr-4890000000-f28cf81d99fed0ca9b81
Source of Spectrum U1-2020-2049-4g
Wiley ID 1860430