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2H-Pyran-2-one, 6-[2-(1,3-benzodioxol-5-yl)ethenyl]-5,6-dihydro-5-hydroxy-4-methoxy-, [5R-[5.alpha.,6.alpha.(E)]]-
SpectraBase Compound ID FilgpEBquHc
InChI InChI=1S/C15H14O6/c1-18-13-7-14(16)21-11(15(13)17)5-3-9-2-4-10-12(6-9)20-8-19-10/h2-7,11,15,17H,8H2,1H3/b5-3+/t11-,15+/m0/s1
InChIKey ILCFKVGBAOFCMD-YQRHFANHSA-N
Mol Weight 290.27 g/mol
Molecular Formula C15H14O6
Exact Mass 290.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3N3fQntQXW5
Name 2H-Pyran-2-one, 6-[2-(1,3-benzodioxol-5-yl)ethenyl]-5,6-dihydro-5-hydroxy-4-methoxy-, [5R-[5.alpha.,6.alpha.(E)]]-
CAS Registry Number 52525-97-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O6
InChI InChI=1S/C15H14O6/c1-18-13-7-14(16)21-11(15(13)17)5-3-9-2-4-10-12(6-9)20-8-19-10/h2-7,11,15,17H,8H2,1H3/b5-3+/t11-,15+/m0/s1
InChIKey ILCFKVGBAOFCMD-YQRHFANHSA-N
Molecular Weight 290.271 g/mol
SMILES O[C@]1(C(=CC(O[C@]1(\C=C\c1cc2OCOc2cc1)[H])=O)OC)[H]
SPLASH splash10-01ti-1910000000-ead270572c77260ebffb
Source of Spectrum K-106-3125-882
Synonyms (5R,6S)-6-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-5-hydroxy-4-methoxy-5,6-dihydro-2H-pyran-2-one 5,6-cis-5-hydroxymethysticin (2S,3R)-2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-hydroxy-4-methoxy-2,3-dihydropyran-6-one (2S,3R)-2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-methoxy-3-oxidanyl-2,3-dihydropyran-6-one
Wiley ID 1293386