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(R*)-tert-Butyl 2-((S*)-2-(4-bromophenyl)-5-oxotetrahydrofuran-2-yl)propanoate
SpectraBase Compound ID hNoNUDt4WM
InChI InChI=1S/C17H21BrO4/c1-11(15(20)22-16(2,3)4)17(10-9-14(19)21-17)12-5-7-13(18)8-6-12/h5-8,11H,9-10H2,1-4H3/t11-,17-/m0/s1
InChIKey CVLVQJAITWPHSE-GTNSWQLSSA-N
Mol Weight 369.26 g/mol
Molecular Formula C17H21BrO4
Exact Mass 368.062322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6pv825I4aD5
Name (R*)-tert-Butyl 2-((S*)-2-(4-bromophenyl)-5-oxotetrahydrofuran-2-yl)propanoate
Appearance Colorless oil
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Formula C17H21BrO4
InChI InChI=1S/C17H21BrO4/c1-11(15(20)22-16(2,3)4)17(10-9-14(19)21-17)12-5-7-13(18)8-6-12/h5-8,11H,9-10H2,1-4H3/t11-,17-/m0/s1
InChIKey CVLVQJAITWPHSE-GTNSWQLSSA-N
Instrument Name HP 6890/5973
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.11.23
Molecular Weight 369.255 g/mol
Reported Formula C17H21BrO4
SMILES [C@@]1(OC(CC1)=O)(c1ccc(cc1)Br)[C@](C(OC(C)(C)C)=O)(C)[H]
SPLASH splash10-0006-1290000000-1e0ca09c3b478ad04e00
Sample Comments dr = 75:25
Source of Spectrum BJO-11-SM8-anti-3de
Thin-Layer Chromatography Rf = 0.43 (EA/PE, 20:80)
Wiley ID 1854210