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(3R,4S)-4-hydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-2-benzopyran-5,8-dione
SpectraBase Compound ID 2Wad5lZODen
InChI InChI=1S/C11H12O5/c1-5-10(13)9-6(4-16-5)7(12)3-8(15-2)11(9)14/h3,5,10,13H,4H2,1-2H3/t5-,10-/m1/s1
InChIKey BQENSOQYNWAMCH-GPXNAGAYSA-N
Mol Weight 224.21 g/mol
Molecular Formula C11H12O5
Exact Mass 224.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Lpw7bOC9lT
Name (3R,4S)-4-hydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-2-benzopyran-5,8-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O5
InChI InChI=1S/C11H12O5/c1-5-10(13)9-6(4-16-5)7(12)3-8(15-2)11(9)14/h3,5,10,13H,4H2,1-2H3/t5-,10-/m1/s1
InChIKey BQENSOQYNWAMCH-GPXNAGAYSA-N
Molecular Weight 224.212 g/mol
SMILES O[C@]1(C2=C(C(=O)C=C(C2=O)OC)CO[C@@]1(C)[H])[H]
SPLASH splash10-00lr-5900000000-10696c5fe56bf9eedbc5
Source of Spectrum F-57-9632-9
Synonyms (3R,4S)-4-hydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-isochromene-5,8-dione (3R,4S)-4-hydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-isochromene-5,8-quinone (3R,4S)-6-methoxy-3-methyl-4-oxidanyl-3,4-dihydro-1H-isochromene-5,8-dione
Wiley ID 1626535