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(1S,2R)/(1R,2S)-1-(3-Methylphenyl)-3-oxo-2,3-diphenylpropyl Acetate
SpectraBase Compound ID 2S51DJVqx4a
InChI InChI=1S/C24H22O3/c1-17-10-9-15-21(16-17)24(27-18(2)25)22(19-11-5-3-6-12-19)23(26)20-13-7-4-8-14-20/h3-16,22,24H,1-2H3/t22-,24+/m0/s1
InChIKey VSYLPPUEUIVPNV-LADGPHEKSA-N
Mol Weight 358.44 g/mol
Molecular Formula C24H22O3
Exact Mass 358.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FfiP41FhFjE
Name (1S,2R)/(1R,2S)-1-(3-Methylphenyl)-3-oxo-2,3-diphenylpropyl Acetate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22O3
InChI InChI=1S/C24H22O3/c1-17-10-9-15-21(16-17)24(27-18(2)25)22(19-11-5-3-6-12-19)23(26)20-13-7-4-8-14-20/h3-16,22,24H,1-2H3/t22-,24+/m0/s1
InChIKey VSYLPPUEUIVPNV-LADGPHEKSA-N
Instrument Name Agilent Technologies (HP) 5973
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901647
Molecular Weight 358.437 g/mol
SMILES c1c(cccc1)[C@]([C@@](c1cc(ccc1)C)(OC(=O)C)[H])(C(=O)c1ccccc1)[H]
SPLASH splash10-0a6s-3921000000-98941c9065f13dec6354
Source of Spectrum U1-2020-2049-4b
Wiley ID 1860425