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(2S*,3R*)-3-(Hydroxymethyl)-2-(3,4-methylenedioxyphenyl)tetrahydrofuran-4-one
SpectraBase Compound ID KBRjpZ1HInb
InChI InChI=1S/C12H12O5/c13-4-8-9(14)5-15-12(8)7-1-2-10-11(3-7)17-6-16-10/h1-3,8,12-13H,4-6H2/t8-,12+/m0/s1
InChIKey KTKCYRGDDDTKDN-QPUJVOFHSA-N
Mol Weight 236.22 g/mol
Molecular Formula C12H12O5
Exact Mass 236.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DyHIKDgbqEu
Name (2S*,3R*)-3-(Hydroxymethyl)-2-(3,4-methylenedioxyphenyl)tetrahydrofuran-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O5
InChI InChI=1S/C12H12O5/c13-4-8-9(14)5-15-12(8)7-1-2-10-11(3-7)17-6-16-10/h1-3,8,12-13H,4-6H2/t8-,12+/m0/s1
InChIKey KTKCYRGDDDTKDN-QPUJVOFHSA-N
Molecular Weight 236.223 g/mol
SMILES OC[C@@]1([C@](OCC1=O)(c1cc2OCOc2cc1)[H])[H]
SPLASH splash10-052r-0890000000-a045a5435ec22ab42bdb
Source of Spectrum J-73-6278-46
Synonyms (4R,5S)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)-3-oxolanone (4R,5S)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)tetrahydrofuran-3-one (4R,5S)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)oxolan-3-one
Wiley ID 1668533