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2-Propanone, 1-(5-methoxy-3-benzofuranyl)-
SpectraBase Compound ID JKqQzrqr4Yd
InChI InChI=1S/C12H12O3/c1-8(13)5-9-7-15-12-4-3-10(14-2)6-11(9)12/h3-4,6-7H,5H2,1-2H3
InChIKey SITQCVWRMFSBMQ-UHFFFAOYSA-N
Mol Weight 204.22 g/mol
Molecular Formula C12H12O3
Exact Mass 204.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E5EpafTKRYL
Name 2-Propanone, 1-(5-methoxy-3-benzofuranyl)-
Alternate Name(s) 1-(5-methoxy-1-benzofuran-3-yl)acetone 1-(5-methoxy-1-benzofuran-3-yl)propan-2-one 1-(5-methoxy-3-benzofuranyl)-2-propanone 1-(5-methoxybenzofuran-3-yl)acetone 1-(5-methoxybenzofuran-3-yl)propan-2-one
CAS Registry Number 56798-52-8
Comments Less than 3 mono-isotopic peaks
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Formula C12H12O3
InChI InChI=1S/C12H12O3/c1-8(13)5-9-7-15-12-4-3-10(14-2)6-11(9)12/h3-4,6-7H,5H2,1-2H3
InChIKey SITQCVWRMFSBMQ-UHFFFAOYSA-N
Molecular Weight 204.225 g/mol
SMILES c1(c2c(ccc(c2)OC)oc1)CC(=O)C
SPLASH splash10-03di-0940000000-458ef955942502191a05
Source of Spectrum B-28-1106-0
Wiley ID 1201801