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2,4-Pentanedione, 3-[(4-aminophenyl)methyl]-
SpectraBase Compound ID 5OrJFAamaYR
InChI InChI=1S/C12H15NO2/c1-8(14)12(9(2)15)7-10-3-5-11(13)6-4-10/h3-6,12H,7,13H2,1-2H3
InChIKey GYYOJPBJJDQMSN-UHFFFAOYSA-N
Mol Weight 205.26 g/mol
Molecular Formula C12H15NO2
Exact Mass 205.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FH4yv0autH
Name 2,4-Pentanedione, 3-[(4-aminophenyl)methyl]-
Alternate Name(s) 3-(4-aminobenzyl)pentane-2,4-dione 3-[(4-aminophenyl)methyl]pentane-2,4-dione
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Formula C12H15NO2
InChI InChI=1S/C12H15NO2/c1-8(14)12(9(2)15)7-10-3-5-11(13)6-4-10/h3-6,12H,7,13H2,1-2H3
InChIKey GYYOJPBJJDQMSN-UHFFFAOYSA-N
Molecular Weight 205.257 g/mol
SMILES Nc1ccc(CC(C(C)=O)C(C)=O)cc1
SPLASH splash10-0a4l-5900000000-e89f5f96e846ac86e9fa
Source of Spectrum JX-2015-5-770
Wiley ID 1727526