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3-(2'-Oxopropyl)isochromen-1-one
SpectraBase Compound ID 3scBcGaE0z0
InChI InChI=1S/C12H10O3/c1-8(13)6-10-7-9-4-2-3-5-11(9)12(14)15-10/h2-5,7H,6H2,1H3
InChIKey BZUCRGYEYXQMAZ-UHFFFAOYSA-N
Mol Weight 202.21 g/mol
Molecular Formula C12H10O3
Exact Mass 202.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5T2A0qHKhdq
Name 3-(2'-Oxopropyl)isochromen-1-one
Alternate Name(s) 3-(2-oxopropyl)-2-benzopyran-1-one 3-(2-oxopropyl)isochromen-1-one 3-Acetonylisochromen-1-one 3-(2-oxidanylidenepropyl)isochromen-1-one
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Formula C12H10O3
InChI InChI=1S/C12H10O3/c1-8(13)6-10-7-9-4-2-3-5-11(9)12(14)15-10/h2-5,7H,6H2,1H3
InChIKey BZUCRGYEYXQMAZ-UHFFFAOYSA-N
Molecular Weight 202.209 g/mol
SMILES C1(OC(CC(=O)C)=Cc2c1cccc2)=O
SPLASH splash10-03dl-4920000000-788fd4e8758bbb890e4e
Source of Spectrum U1-2010-3086-14
Wiley ID 1663773