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(1'R*,2'S*,3'S*,4S*)-4-(1',2',3'-Trihydroxy-3'-phenylpropyl)-2-buten-4-olide
SpectraBase Compound ID D0UXJQIt6lp
InChI InChI=1S/C13H14O5/c14-10-7-6-9(18-10)12(16)13(17)11(15)8-4-2-1-3-5-8/h1-7,9,11-13,15-17H/t9-,11-,12-,13-/m0/s1
InChIKey FJBARMGOBUNTIH-BQUFFADESA-N
Mol Weight 250.25 g/mol
Molecular Formula C13H14O5
Exact Mass 250.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Q9Av2Q3SLd
Name (1'R*,2'S*,3'S*,4S*)-4-(1',2',3'-Trihydroxy-3'-phenylpropyl)-2-buten-4-olide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O5
InChI InChI=1S/C13H14O5/c14-10-7-6-9(18-10)12(16)13(17)11(15)8-4-2-1-3-5-8/h1-7,9,11-13,15-17H/t9-,11-,12-,13-/m0/s1
InChIKey FJBARMGOBUNTIH-BQUFFADESA-N
Molecular Weight 250.250 g/mol
SMILES O[C@]([C@]([C@](c1ccccc1)(O)[H])(O)[H])([C@]1(OC(=O)C=C1)[H])[H]
SPLASH splash10-0a6r-4900000000-8366906a09ea184fc46d
Source of Spectrum F-52-6555-17
Synonyms (5S)-5-[(1R,2S,3S)-1,2,3-trihydroxy-3-phenylpropyl]-2,5-dihydrofuran-2-one
Wiley ID 796571