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STEPPOGENIN
SpectraBase Compound ID K8rjJs5WRfl
InChI InChI=1S/C15H12O6/c16-7-1-2-9(10(18)3-7)13-6-12(20)15-11(19)4-8(17)5-14(15)21-13/h1-5,13,16-19H,6H2/t13-/m0/s1
InChIKey QBLQLKNOKUHRCH-ZDUSSCGKSA-N
Mol Weight 288.25 g/mol
Molecular Formula C15H12O6
Exact Mass 288.063388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4d7735Wh9MI
Name (2S)-5,7,2',4'-tetrahydroxyflavanone
Appearance needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12O6
InChI InChI=1S/C15H12O6/c16-7-1-2-9(10(18)3-7)13-6-12(20)15-11(19)4-8(17)5-14(15)21-13/h1-5,13,16-19H,6H2/t13-/m0/s1
InChIKey QBLQLKNOKUHRCH-ZDUSSCGKSA-N
Instrument Name Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1021/np010288l
Molecular Weight 288.255 g/mol
Optical Rotation [a]D20 = +2.5 (c = 0.32, MeOH)
SMILES Oc1cc(cc2O[C@](c3ccc(cc3O)O)(CC(c12)=O)[H])O
SPLASH splash10-0fk9-0790000000-2060d6104f86881c7cdb
Source of Spectrum G4-64-SM1-14
Wiley ID 1882893