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(1R,5R,6S,7R)-5-(hydroxymethyl)-6-(4-hydroxyphenyl)-2-oxidanylidene-8-oxabicyclo[3.2.1]oct-3-ene-7-carboxylic acid
SpectraBase Compound ID Lghch8QIgPL
InChI InChI=1S/C15H14O6/c16-7-15-6-5-10(18)13(21-15)11(14(19)20)12(15)8-1-3-9(17)4-2-8/h1-6,11-13,16-17H,7H2,(H,19,20)/t11-,12-,13+,15+/m1/s1
InChIKey IJGLRFRYPAUECC-CXTNEJHOSA-N
Mol Weight 290.27 g/mol
Molecular Formula C15H14O6
Exact Mass 290.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HhlRPQ8Zbro
Name (1R,5R,6S,7R)-5-(hydroxymethyl)-6-(4-hydroxyphenyl)-2-oxidanylidene-8-oxabicyclo[3.2.1]oct-3-ene-7-carboxylic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O6
InChI InChI=1S/C15H14O6/c16-7-15-6-5-10(18)13(21-15)11(14(19)20)12(15)8-1-3-9(17)4-2-8/h1-6,11-13,16-17H,7H2,(H,19,20)/t11-,12-,13+,15+/m1/s1
InChIKey IJGLRFRYPAUECC-CXTNEJHOSA-N
Molecular Weight 290.271 g/mol
SMILES Oc1ccc([C@]2([C@]3(CO)O[C@]([C@@]2(C(=O)O)[H])(C(C=C3)=O)[H])[H])cc1
SPLASH splash10-004i-0910000000-5c8523b25876948d7be1
Source of Spectrum G4-63-1165-1
Synonyms (1R,5R,6S,7R)-5-(hydroxymethyl)-6-(4-hydroxyphenyl)-2-oxo-8-oxabicyclo[3.2.1]oct-3-ene-7-carboxylic acid (1R,5R,6S,7R)-6-(4-hydroxyphenyl)-2-keto-5-methylol-8-oxabicyclo[3.2.1]oct-3-ene-7-carboxylic acid
Wiley ID 1608619