For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(1S,2R)/(1R,2S)-3-(4-Chlorophenyl)-3-oxo-2-phenyl-1-(3,4,5-trimethoxyphenyl)propyl Propionate
SpectraBase Compound ID FSC65DQUXoO
InChI InChI=1S/C27H27ClO6/c1-5-23(29)34-26(19-15-21(31-2)27(33-4)22(16-19)32-3)24(17-9-7-6-8-10-17)25(30)18-11-13-20(28)14-12-18/h6-16,24,26H,5H2,1-4H3/t24-,26+/m0/s1
InChIKey UECACNYENXYXND-AZGAKELHSA-N
Mol Weight 482.96 g/mol
Molecular Formula C27H27ClO6
Exact Mass 482.149616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5yMwmRt3KH5
Name (1S,2R)/(1R,2S)-3-(4-Chlorophenyl)-3-oxo-2-phenyl-1-(3,4,5-trimethoxyphenyl)propyl Propionate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H27ClO6
InChI InChI=1S/C27H27ClO6/c1-5-23(29)34-26(19-15-21(31-2)27(33-4)22(16-19)32-3)24(17-9-7-6-8-10-17)25(30)18-11-13-20(28)14-12-18/h6-16,24,26H,5H2,1-4H3/t24-,26+/m0/s1
InChIKey UECACNYENXYXND-AZGAKELHSA-N
Instrument Name Agilent Technologies (HP) 5973
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901647
Molecular Weight 482.960 g/mol
SMILES c1c([C@]([C@@](c2cc(c(c(c2)OC)OC)OC)(OC(=O)CC)[H])(C(=O)c2ccc(cc2)Cl)[H])cccc1
SPLASH splash10-0002-0930000000-8994a85dba1b53599091
Source of Spectrum U1-2020-2050-4l
Wiley ID 1860435