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(3S*,5R*)-5-(2-Bromophenyl)-3-(4-methoxyphenyl)-2-methylisoxazolidine
SpectraBase Compound ID 34yRfMZdycR
InChI InChI=1S/C17H18BrNO2/c1-19-16(12-7-9-13(20-2)10-8-12)11-17(21-19)14-5-3-4-6-15(14)18/h3-10,16-17H,11H2,1-2H3/t16-,17+/m0/s1
InChIKey KEFJDLISEFWQPO-DLBZAZTESA-N
Mol Weight 348.24 g/mol
Molecular Formula C17H18BrNO2
Exact Mass 347.052092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4mWNM7ill1w
Name (3S*,5R*)-5-(2-Bromophenyl)-3-(4-methoxyphenyl)-2-methylisoxazolidine
Alternate Name(s) (3S,5R)-5-(2-bromophenyl)-3-(4-methoxyphenyl)-2-methylisoxazolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18BrNO2
InChI InChI=1S/C17H18BrNO2/c1-19-16(12-7-9-13(20-2)10-8-12)11-17(21-19)14-5-3-4-6-15(14)18/h3-10,16-17H,11H2,1-2H3/t16-,17+/m0/s1
InChIKey KEFJDLISEFWQPO-DLBZAZTESA-N
Molecular Weight 348.240 g/mol
SMILES [C@@]1(ON([C@@](C1)(c1ccc(cc1)OC)[H])C)(c1c(Br)cccc1)[H]
SPLASH splash10-03xr-2901000000-1215d82d14e554177d3c
Source of Spectrum U1-2014-7127-16a
Wiley ID 1741061