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8-Iodo-umbelliferone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

8-Iodo-umbelliferone
SpectraBase Compound ID Fxlp00Oamwj
InChI InChI=1S/C9H5IO3/c10-8-6(11)3-1-5-2-4-7(12)13-9(5)8/h1-4,11H
InChIKey PTQBFNVKLBJCEW-UHFFFAOYSA-N
Mol Weight 288.04 g/mol
Molecular Formula C9H5IO3
Exact Mass 287.928339 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtwoomFiMDE
Name 7-Hydroxy-8-iodocoumarin
Alternate Name(s) 7-Hydroxy-8-iodo-1-benzopyran-2-one 7-Hydroxy-8-iodo-chromen-2-one 8-iodanyl-7-oxidanyl-chromen-2-one 7-Hydroxy-8-iodochromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H5IO3
InChI InChI=1S/C9H5IO3/c10-8-6(11)3-1-5-2-4-7(12)13-9(5)8/h1-4,11H
InChIKey PTQBFNVKLBJCEW-UHFFFAOYSA-N
Molecular Weight 288.040 g/mol
SMILES Oc1ccc2C=CC(Oc2c1I)=O
SPLASH splash10-01p9-0190000000-c93563508e5b427ca6a5
Source of Spectrum Y4-81-107-0
Wiley ID 1513300