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2H-Pyran-2-one, 6-[2-(1,3-benzodioxol-5-yl)ethenyl]-5,6-dihydro-5-hydroxy-4-methoxy-, [5S-[5.alpha.,6.beta.(E)]]-
SpectraBase Compound ID 3iM7J0ThcjA
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+
InChIKey ILCFKVGBAOFCMD-HWKANZROSA-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 LZhRgzbWZK7
Name 2H-Pyran-2-one, 6-[2-(1,3-benzodioxol-5-yl)ethenyl]-5,6-dihydro-5-hydroxy-4-methoxy-, [5S-[5.alpha.,6.beta.(E)]]-
CAS Registry Number 52525-98-1
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+
InChIKey ILCFKVGBAOFCMD-HWKANZROSA-N
Molecular Weight 290.271 g/mol
SMILES OC1C(OC(C=C1OC)=O)\C=C\c1cc2c(OCO2)cc1
SPLASH splash10-01ti-1910000000-dfb41bd00eab48934cb1
Source of Spectrum K-106-3125-992
Synonyms 6-[(E)-2-(1,3-Benzodioxol-5-yl)ethenyl]-5-hydroxy-4-methoxy-5,6-dihydro-2H-pyran-2-one 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-hydroxy-4-methoxy-2,3-dihydropyran-6-one 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-methoxy-3-oxidanyl-2,3-dihydropyran-6-one 2-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-3-hydroxy-4-methoxy-2,3-dihydropyran-6-one 5,6-trans-5-Hydroxymethysticin
Wiley ID 1293385