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8-Hydroxycoumarin

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

8-Hydroxycoumarin
SpectraBase Compound ID BEkJ3V4nuur
InChI InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H
InChIKey DPTUTXWBBUARQB-UHFFFAOYSA-N
Mol Weight 162.14 g/mol
Molecular Formula C9H6O3
Exact Mass 162.031694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9EcYr60ggNg
Name 8-Hydroxycoumarin
CAS Registry Number 2442-31-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6O3
InChI InChI=1S/C9H6O3/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5,10H
InChIKey DPTUTXWBBUARQB-UHFFFAOYSA-N
Molecular Weight 162.144 g/mol
SMILES Oc1cccc2C=CC(Oc12)=O
SPLASH splash10-03e9-0900000000-d2e4186d527399b68d15
Source of Spectrum C-118-8341-8
Synonyms 8-Hydroxy-2H-chromen-2-one 2H-1-Benzopyran-2-one, 8-hydroxy- 8-hydroxy-1-benzopyran-2-one 8-hydroxychromen-2-one 8-oxidanylchromen-2-one
Wiley ID 759835