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m-diacetonybenzene
SpectraBase Compound ID 6TtOGOzyT7g
InChI InChI=1S/C12H14O2/c1-9(13)6-11-4-3-5-12(8-11)7-10(2)14/h3-5,8H,6-7H2,1-2H3
InChIKey PEWCBOLWEVQBLM-UHFFFAOYSA-N
Mol Weight 190.24 g/mol
Molecular Formula C12H14O2
Exact Mass 190.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4gUbBIjNwb1
Name m-diacetonybenzene
Alternate Name(s) 1-[3-(2-Oxopropyl)phenyl]acetone 1-[3-(2-oxopropyl)phenyl]-2-propanone 1-[3-(2-oxopropyl)phenyl]propan-2-one 1-(3-acetonylphenyl)propan-2-one 1-[3-(2-oxidanylidenepropyl)phenyl]propan-2-one
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Formula C12H14O2
InChI InChI=1S/C12H14O2/c1-9(13)6-11-4-3-5-12(8-11)7-10(2)14/h3-5,8H,6-7H2,1-2H3
InChIKey PEWCBOLWEVQBLM-UHFFFAOYSA-N
Molecular Weight 190.242 g/mol
SMILES c1(cc(CC(=O)C)ccc1)CC(=O)C
SPLASH splash10-0006-9600000000-7ad8b3609128e8d08aaf
Source of Spectrum AJ-57-245-0
Wiley ID 1186756