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(1S,2R)/(1R,2S)-1-(4-Methoxyphenyl)-3-oxo-2,3-diphenylpropyl 2-Bromoacetate
SpectraBase Compound ID Hdi7qCGKa32
InChI InChI=1S/C24H21BrO4/c1-28-20-14-12-19(13-15-20)24(29-21(26)16-25)22(17-8-4-2-5-9-17)23(27)18-10-6-3-7-11-18/h2-15,22,24H,16H2,1H3/t22-,24+/m0/s1
InChIKey VNPXCBMPPRDLAM-LADGPHEKSA-N
Mol Weight 453.33 g/mol
Molecular Formula C24H21BrO4
Exact Mass 452.062322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dmfSDdtJGZ
Name (1S,2R)/(1R,2S)-1-(4-Methoxyphenyl)-3-oxo-2,3-diphenylpropyl 2-Bromoacetate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21BrO4
InChI InChI=1S/C24H21BrO4/c1-28-20-14-12-19(13-15-20)24(29-21(26)16-25)22(17-8-4-2-5-9-17)23(27)18-10-6-3-7-11-18/h2-15,22,24H,16H2,1H3/t22-,24+/m0/s1
InChIKey VNPXCBMPPRDLAM-LADGPHEKSA-N
Instrument Name Agilent Technologies (HP) 5973
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901647
Molecular Weight 453.332 g/mol
SMILES c1ccccc1[C@@](C(c1ccccc1)=O)([C@](OC(CBr)=O)(c1ccc(cc1)OC)[H])[H]
SPLASH splash10-0a4r-2930000000-cc73377d689db072dc2c
Source of Spectrum U1-2020-2050-4o
Wiley ID 1860438