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2,3,4,6-tetrahydroxy-5H-benzocyclohepten-5-one

View entire compound with spectra: 4 NMR, 3 FTIR, and 2 MS (GC)

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

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 4ds0gDX2G56
Name 2,3,4,6-TETRAHYDROXY-5H-BENZOCYCLOHEPTEN-5-ONE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Catalog Number P 542
Copyright Copyright © 1980, 1981-2024 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
Molecular Weight 220.179993
Synonyms 5H-BENZOCYCLOHEPTEN-5-ONE, 2,3,4,6- TETRAHYDROXY-, PURPUROGALLIN
Technique KBr WAFER