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4-Hydroxy-4-(2-nitrophenyl)butan-2-one
SpectraBase Compound ID 6nx74Q17UiS
InChI InChI=1S/C10H11NO4/c1-7(12)6-10(13)8-4-2-3-5-9(8)11(14)15/h2-5,10,13H,6H2,1H3
InChIKey QLWGGIGZONFVIO-UHFFFAOYSA-N
Mol Weight 209.2 g/mol
Molecular Formula C10H11NO4
Exact Mass 209.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BHgrqSEBxwT
Name 4-Hydroxy-4-(2-nitrophenyl)butan-2-one
Alternate Name(s) 4-Hydroxy-4-(2-nitrophenyl)-2-butanone (R)-4-Hydroxy-4-(2-nitrophenyl)butan-2-one 4-(2-nitrophenyl)-4-oxidanyl-butan-2-one
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Formula C10H11NO4
InChI InChI=1S/C10H11NO4/c1-7(12)6-10(13)8-4-2-3-5-9(8)11(14)15/h2-5,10,13H,6H2,1H3
InChIKey QLWGGIGZONFVIO-UHFFFAOYSA-N
Molecular Weight 209.201 g/mol
SMILES OC(c1c(N(=O)=O)cccc1)CC(=O)C
SPLASH splash10-0ue9-2900000000-ebdbe7318df62945539b
Source of Spectrum QC-24-1040-20
Wiley ID 1738856