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2-Butanone, 4-hydroxy-4-(5-methoxy-2-nitrophenyl)-
SpectraBase Compound ID 5pxXRM7nce6
InChI InChI=1S/C11H13NO5/c1-7(13)5-11(14)9-6-8(17-2)3-4-10(9)12(15)16/h3-4,6,11,14H,5H2,1-2H3
InChIKey FISDBZIJXQUURP-UHFFFAOYSA-N
Mol Weight 239.23 g/mol
Molecular Formula C11H13NO5
Exact Mass 239.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KUP2R9JF0wp
Name 2-Butanone, 4-hydroxy-4-(5-methoxy-2-nitrophenyl)-
Alternate Name(s) 4-(5-Methoxy-2-nitro-phenyl)-4-oxidanyl-butan-2-one 4-Hydroxy-4-(5-methoxy-2-nitro-phenyl)butan-2-one 4-Hydroxy-4-(5-methoxy-2-nitrophenyl)-2-butanone
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Formula C11H13NO5
InChI InChI=1S/C11H13NO5/c1-7(13)5-11(14)9-6-8(17-2)3-4-10(9)12(15)16/h3-4,6,11,14H,5H2,1-2H3
InChIKey FISDBZIJXQUURP-UHFFFAOYSA-N
Molecular Weight 239.227 g/mol
SMILES OC(c1cc(ccc1N(=O)=O)OC)CC(C)=O
SPLASH splash10-0006-8900000000-50e9594a05eb1f6409c3
Wiley ID 1491729