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2,3,4,6-tetrahydroxy-5H-benzocyclohepten-5-one
SpectraBase Compound ID DTuo8ijZMsA
InChI InChI=1S/C11H8O5/c12-6-3-1-2-5-4-7(13)10(15)11(16)8(5)9(6)14/h1-4,13,15-16H,(H,12,14)
InChIKey WDGFFVCWBZVLCE-UHFFFAOYSA-N
Mol Weight 220.18 g/mol
Molecular Formula C11H8O5
Exact Mass 220.037173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ypslpCBWUu
Name 2,3,4,5-tetrahydroxy-6H-benzo[7]annulen-6-one
Appearance Orange powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8O5
InChI InChI=1S/C11H8O5/c12-6-3-1-2-5-4-7(13)10(15)11(16)8(5)9(6)14/h1-4,13,15-16H,(H,12,14)
InChIKey WDGFFVCWBZVLCE-UHFFFAOYSA-N
Instrument Name HP 6890N-5975
Ionization Type EI
Literature Reference DOI 10.1002/cctc.201901659
Molecular Weight 220.180 g/mol
SMILES OC=1C(C=CC=C2C1C(=C(C(=C2)O)O)O)=O
SPLASH splash10-00dj-3970000000-d125591387bc558c2762
Source of Spectrum CCC-12-SM5-2h
Wiley ID 1839819