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4,6-dimethyl-3a,7a-dihydro-2-benzofuran-1,3-dione
SpectraBase Compound ID Ix1ZYelXiJi
InChI InChI=1S/C10H10O3/c1-5-3-6(2)8-7(4-5)9(11)13-10(8)12/h3-4,7-8H,1-2H3
InChIKey MHWWMXOGDJEIPB-UHFFFAOYSA-N
Mol Weight 178.19 g/mol
Molecular Formula C10H10O3
Exact Mass 178.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68OwtqdvWQG
Name 4,6-dimethyl-3a,7a-dihydro-2-benzofuran-1,3-dione
Alternate Name(s) 4,6-dimethyl-3a,7a-dihydroisobenzofuran-1,3-dione 4,6-dimethyl-3a,7a-dihydroisobenzofuran-1,3-quinone
Comments Less than 3 mono-isotopic peaks
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Formula C10H10O3
InChI InChI=1S/C10H10O3/c1-5-3-6(2)8-7(4-5)9(11)13-10(8)12/h3-4,7-8H,1-2H3
InChIKey MHWWMXOGDJEIPB-UHFFFAOYSA-N
Molecular Weight 178.187 g/mol
SMILES C1(OC(=O)C2C1C(=CC(C)=C2)C)=O
SPLASH splash10-0006-9100000000-b51505e62425ef2acbe5
Source of Spectrum Y-28-550-2
Wiley ID 1173980