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2,5-Dihydroxy-4-(2-hydroxyethoxy)cyclohepta-2,4,6-trien-1-one
SpectraBase Compound ID LrGLMtudIHv
InChI InChI=1S/C9H10O5/c10-3-4-14-9-5-8(13)6(11)1-2-7(9)12/h1-2,5,10,12H,3-4H2,(H,11,13)
InChIKey OPDBEQFZPMWIGM-UHFFFAOYSA-N
Mol Weight 198.17 g/mol
Molecular Formula C9H10O5
Exact Mass 198.052823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nMHTXqgWx2
Name 2,5-Dihydroxy-4-(2-hydroxyethoxy)cyclohepta-2,4,6-trien-1-one
Alternate Name(s) 2,5-Dihydroxy-4-(2-hydroxyethoxy)-2,4,6-cycloheptatrien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O5
InChI InChI=1S/C9H10O5/c10-3-4-14-9-5-8(13)6(11)1-2-7(9)12/h1-2,5,10,12H,3-4H2,(H,11,13)
InChIKey OPDBEQFZPMWIGM-UHFFFAOYSA-N
Molecular Weight 198.174 g/mol
SMILES OC=1C=CC(C(=CC1OCCO)O)=O
SPLASH splash10-03fr-9300000000-ea2687eaa23a882a6a1d
Source of Spectrum F-62-4008-37
Wiley ID 1633011