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(-)-(2R,3R)-2-(3',4'-DIHYDROXYBENZYL)-3-(3'',4''-DIHYDROXYBENZYL)-BUTYROLACTONE
SpectraBase Compound ID 5ojZDl2DOaN
InChI InChI=1S/C18H18O6/c19-14-3-1-10(7-16(14)21)5-12-9-24-18(23)13(12)6-11-2-4-15(20)17(22)8-11/h1-4,7-8,12-13,19-22H,5-6,9H2/t12-,13+/m0/s1
InChIKey NXJDDTDNGCHIGR-QWHCGFSZSA-N
Mol Weight 330.34 g/mol
Molecular Formula C18H18O6
Exact Mass 330.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 96gQtF9v8qW
Name (2R,3R)-2,3-Bis(3,4-dihydroxybenzyl)butyrolactone
CAS Registry Number 119098-95-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O6
InChI InChI=1S/C18H18O6/c19-14-3-1-10(7-16(14)21)5-12-9-24-18(23)13(12)6-11-2-4-15(20)17(22)8-11/h1-4,7-8,12-13,19-22H,5-6,9H2/t12-,13+/m0/s1
InChIKey NXJDDTDNGCHIGR-QWHCGFSZSA-N
Molecular Weight 330.336 g/mol
SMILES Oc1cc(C[C@]2(COC([C@@]2(Cc2ccc(c(c2)O)O)[H])=O)[H])ccc1O
SPLASH splash10-00di-3901000000-1a93c711ef4558c37912
Source of Spectrum B-41-317-4
Synonyms (3R,4R)-3,4-bis[(3,4-dihydroxyphenyl)methyl]-2-oxolanone (3R,4R)-3,4-bis[(3,4-dihydroxyphenyl)methyl]oxolan-2-one (3R,4R)-3,4-bis[(3,4-dihydroxyphenyl)methyl]tetrahydrofuran-2-one (3R,4R)-3,4-bis[[3,4-bis(oxidanyl)phenyl]methyl]oxolan-2-one (3R,4R)-3,4-diprotocatechuyltetrahydrofuran-2-one
Wiley ID 1327787