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2-Hydroxy-4-(2'-hydroxy-3'-hydroxymethyl-4'-methoxy-6'-methylbenzoyloxy)-3,6-dimethylbenzoic acid
SpectraBase Compound ID BZliGYZRh35
InChI InChI=1S/C19H20O8/c1-8-5-12(10(3)16(21)14(8)18(23)24)27-19(25)15-9(2)6-13(26-4)11(7-20)17(15)22/h5-6,20-22H,7H2,1-4H3,(H,23,24)
InChIKey IDFVAUVLQFUXFQ-UHFFFAOYSA-N
Mol Weight 376.36 g/mol
Molecular Formula C19H20O8
Exact Mass 376.115818 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRtFrqoDtIf
Name 2-Hydroxy-4-(2'-hydroxy-3'-hydroxymethyl-4'-methoxy-6'-methylbenzoyloxy)-3,6-dimethylbenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O8
InChI InChI=1S/C19H20O8/c1-8-5-12(10(3)16(21)14(8)18(23)24)27-19(25)15-9(2)6-13(26-4)11(7-20)17(15)22/h5-6,20-22H,7H2,1-4H3,(H,23,24)
InChIKey IDFVAUVLQFUXFQ-UHFFFAOYSA-N
Molecular Weight 376.361 g/mol
SMILES Oc1c(c(OC(c2c(c(c(cc2C)OC)CO)O)=O)cc(c1C(=O)O)C)C
SPLASH splash10-052r-3900000000-20d89011387bd5dc4644
Source of Spectrum B-46-301-0
Synonyms 2-Hydroxy-4-{[2-hydroxy-3-(hydroxymethyl)-4-methoxy-6-methylbenzoyl]oxy}-3,6-dimethylbenzoic acid
Wiley ID 1357589