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2H-1-Benzopyran-2-one, 8-hydroxy-7-(2-oxopropoxy)-
SpectraBase Compound ID 9OwZSkJ7CFN
InChI InChI=1S/C12H10O5/c1-7(13)6-16-9-4-2-8-3-5-10(14)17-12(8)11(9)15/h2-5,15H,6H2,1H3
InChIKey GXAGWOXEKFFFOS-UHFFFAOYSA-N
Mol Weight 234.21 g/mol
Molecular Formula C12H10O5
Exact Mass 234.052823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BzdAPUPSiK
Name 2H-1-Benzopyran-2-one, 8-hydroxy-7-(2-oxopropoxy)-
CAS Registry Number 68454-23-9
Comments Less than 3 mono-isotopic peaks
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Formula C12H10O5
InChI InChI=1S/C12H10O5/c1-7(13)6-16-9-4-2-8-3-5-10(14)17-12(8)11(9)15/h2-5,15H,6H2,1H3
InChIKey GXAGWOXEKFFFOS-UHFFFAOYSA-N
Molecular Weight 234.207 g/mol
SMILES Oc1c2OC(=O)C=Cc2ccc1OCC(=O)C
SPLASH splash10-000x-0950000000-611f36b68de4ef220e21
Source of Spectrum B-31-1548-0
Synonyms 7-Acetonyloxy-8-hydroxycoumarin 8-hydroxy-7-(2-oxopropoxy)-2H-chromen-2-one
Wiley ID 1235699