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(2S,3R)-3-(p-Bromophenyl)-3-(2'-ethoxyphenoxy)propane-1,2-diol
SpectraBase Compound ID 5eeHcAXqbqq
InChI InChI=1S/C17H19BrO4/c1-2-21-15-5-3-4-6-16(15)22-17(14(20)11-19)12-7-9-13(18)10-8-12/h3-10,14,17,19-20H,2,11H2,1H3/t14-,17+/m0/s1
InChIKey YWRLIBRILYMGLK-WMLDXEAASA-N
Mol Weight 367.24 g/mol
Molecular Formula C17H19BrO4
Exact Mass 366.046672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RYfZOWMB0b
Name (2S,3R)-3-(p-Bromophenyl)-3-(2'-ethoxyphenoxy)propane-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19BrO4
InChI InChI=1S/C17H19BrO4/c1-2-21-15-5-3-4-6-16(15)22-17(14(20)11-19)12-7-9-13(18)10-8-12/h3-10,14,17,19-20H,2,11H2,1H3/t14-,17+/m0/s1
InChIKey YWRLIBRILYMGLK-WMLDXEAASA-N
Molecular Weight 367.239 g/mol
SMILES O[C@@](CO)([C@](Oc1c(OCC)cccc1)(c1ccc(cc1)Br)[H])[H]
SPLASH splash10-01q0-3900000000-bec97a060d1ff822ab41
Source of Spectrum F5-6-2372-7
Synonyms (2S,3R)-3-(4-bromophenyl)-3-(2-ethoxyphenoxy)propane-1,2-diol
Wiley ID 1733478