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(2'S,4'R,5'S)-3-Methyl-5-[4'-hydroxy-5'-(hydroxymethyl)-tetrahydrofuryl]-6-hydroxypyran-2-one
SpectraBase Compound ID CkRKbiycw97
InChI InChI=1S/C11H14O6/c1-5-2-6(11(15)17-10(5)14)8-3-7(13)9(4-12)16-8/h2,7-9,12-13,15H,3-4H2,1H3/t7-,8+,9+/m1/s1
InChIKey SSYLEBHWEXFXCE-VGMNWLOBSA-N
Mol Weight 242.23 g/mol
Molecular Formula C11H14O6
Exact Mass 242.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FuypO7tmwj0
Name (2'S,4'R,5'S)-3-Methyl-5-[4'-hydroxy-5'-(hydroxymethyl)-tetrahydrofuryl]-6-hydroxypyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O6
InChI InChI=1S/C11H14O6/c1-5-2-6(11(15)17-10(5)14)8-3-7(13)9(4-12)16-8/h2,7-9,12-13,15H,3-4H2,1H3/t7-,8+,9+/m1/s1
InChIKey SSYLEBHWEXFXCE-VGMNWLOBSA-N
Molecular Weight 242.227 g/mol
SMILES OC1=C([C@@]2(C[C@]([C@@](O2)(CO)[H])(O)[H])[H])C=C(C(O1)=O)C
SPLASH splash10-0gbc-3930000000-8dea374466b63637f459
Source of Spectrum G4-64-1058-1
Synonyms 3-Methyl-5-[4'-hydroxy-5'-(hydroxymethyl)-tetrahydrofuryl]-6-hydroxypyran-2-one 6-Hydroxy-5-[(2S,4R,5S)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methyl-2H-pyran-2-one Tetillapyrone
Wiley ID 1609131