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2,3-Bis(4-hydroxy-3-methoxybenzyl)-1,2,4-butanetriol
SpectraBase Compound ID CnDErvsCGiq
InChI InChI=1S/C20H26O7/c1-26-18-8-13(3-5-16(18)23)7-15(11-21)20(25,12-22)10-14-4-6-17(24)19(9-14)27-2/h3-6,8-9,15,21-25H,7,10-12H2,1-2H3
InChIKey INPPVVSEQRZCLJ-UHFFFAOYSA-N
Mol Weight 378.42 g/mol
Molecular Formula C20H26O7
Exact Mass 378.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jIZGrrSPJA
Name 2,3-Bis(4-hydroxy-3-methoxybenzyl)-1,2,4-butanetriol
CAS Registry Number 58139-12-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O7
InChI InChI=1S/C20H26O7/c1-26-18-8-13(3-5-16(18)23)7-15(11-21)20(25,12-22)10-14-4-6-17(24)19(9-14)27-2/h3-6,8-9,15,21-25H,7,10-12H2,1-2H3
InChIKey INPPVVSEQRZCLJ-UHFFFAOYSA-N
Molecular Weight 378.421 g/mol
SMILES Oc1ccc(CC(C(Cc2ccc(c(c2)OC)O)(CO)O)CO)cc1OC
SPLASH splash10-000i-2910000000-9c8fa68ed433f2f750d2
Source of Spectrum W5-1989-37672-27864
Synonyms 2,3-bis[(3-methoxy-4-oxidanyl-phenyl)methyl]butane-1,2,4-triol 2,3-bis[(4-hydroxy-3-methoxy-phenyl)methyl]butane-1,2,4-triol 2,3-Divanillylbutane-1,2,4-triol Carinol
Wiley ID 1358713