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[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)oxan-2-yl]methyl 4-hydroxybenzoate
SpectraBase Compound ID 88dwHUMZHAn
InChI InChI=1S/C19H20O9/c20-11-3-1-10(2-4-11)18(25)26-9-14-15(22)16(23)17(24)19(28-14)27-13-7-5-12(21)6-8-13/h1-8,14-17,19-24H,9H2/t14-,15-,16+,17-,19-/m1/s1
InChIKey FTFZXPBVBBJTHV-OGJJZOIMSA-N
Mol Weight 392.36 g/mol
Molecular Formula C19H20O9
Exact Mass 392.110732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YJiowj1hQ
Name [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)oxan-2-yl]methyl 4-hydroxybenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O9
InChI InChI=1S/C19H20O9/c20-11-3-1-10(2-4-11)18(25)26-9-14-15(22)16(23)17(24)19(28-14)27-13-7-5-12(21)6-8-13/h1-8,14-17,19-24H,9H2/t14-,15-,16+,17-,19-/m1/s1
InChIKey FTFZXPBVBBJTHV-OGJJZOIMSA-N
Molecular Weight 392.360 g/mol
SMILES O[C@@]1([C@]([C@](Oc2ccc(cc2)O)(O[C@@]([C@]1(O)[H])(COC(c1ccc(cc1)O)=O)[H])[H])(O)[H])[H]
SPLASH splash10-000y-2917000000-316deb556490c272e38f
Source of Spectrum G4-61-802-1
Synonyms [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)tetrahydropyran-2-yl]methyl 4-hydroxybenzoate [(2R,3S,4S,5R,6S)-3,4,5-tris(oxidanyl)-6-(4-oxidanylphenoxy)oxan-2-yl]methyl 4-oxidanylbenzoate 4-Hydroxybenzoic acid [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)-2-oxanyl]methyl ester
Wiley ID 1607306