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3(2H)-Benzofuranone, 6-methyl-
SpectraBase Compound ID IOsBnPmzyRa
InChI InChI=1S/C9H8O2/c1-6-2-3-7-8(10)5-11-9(7)4-6/h2-4H,5H2,1H3
InChIKey VHAUANQYMZUJPS-UHFFFAOYSA-N
Mol Weight 148.16 g/mol
Molecular Formula C9H8O2
Exact Mass 148.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BixjG9PcO3S
Name 3(2H)-Benzofuranone, 6-methyl-
CAS Registry Number 20895-41-4
Comments Less than 3 mono-isotopic peaks
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Formula C9H8O2
InChI InChI=1S/C9H8O2/c1-6-2-3-7-8(10)5-11-9(7)4-6/h2-4H,5H2,1H3
InChIKey VHAUANQYMZUJPS-UHFFFAOYSA-N
Molecular Weight 148.161 g/mol
SMILES c12c(OCC2=O)cc(cc1)C
SPLASH splash10-014j-0900000000-2b96fd085dad847ab901
Source of Spectrum H1-34-1314-8
Synonyms 6-Methylbenzofuran-3(2H)-one 6-Methyl-1-benzofuran-3(2H)-one 6-Methyl-3(2H)-benzofuranone 6-Methyl-1-benzofuran-3-one 6-Methyl-3-benzofuranone 6-Methylbenzofuran-3-one 6-Methylcoumaran-3-one
Wiley ID 754792