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1-Isopropylamino-4-hydroxy-4-methyl-1-penten-3-one
SpectraBase Compound ID LmkOeEU9zuQ
InChI InChI=1S/C9H17NO2/c1-7(2)10-6-5-8(11)9(3,4)12/h5-7,10,12H,1-4H3/b6-5+
InChIKey LZSBBQZSIHDWNN-AATRIKPKSA-N
Mol Weight 171.24 g/mol
Molecular Formula C9H17NO2
Exact Mass 171.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AnhRjoc01n1
Name 1-Isopropylamino-4-hydroxy-4-methyl-1-penten-3-one
Alternate Name(s) (1E)-4-hydroxy-1-(isopropylamino)-4-methyl-1-penten-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C9H17NO2
InChI InChI=1S/C9H17NO2/c1-7(2)10-6-5-8(11)9(3,4)12/h5-7,10,12H,1-4H3/b6-5+
InChIKey LZSBBQZSIHDWNN-AATRIKPKSA-N
Molecular Weight 171.240 g/mol
SMILES OC(C(\C=C\NC(C)C)=O)(C)C
SPLASH splash10-03di-0900000000-983d14f3d5e93a1f4a19
Source of Spectrum SO-0-476-2
Wiley ID 1541445