2',4'-Dimethylacetoacetanilide(97-36-9) IR1
Product Name2',4'-Dimethylacetoacetanilide
CAS97-36-9
Molecular FormulaC12H15NO2
Molecular Weight205.25
InChIInChI=1S/C12H15NO2/c1-8-4-5-11(9(2)6-8)13-12(15)7-10(3)14/h4-6H,7H2,1-3H3,(H,13,15)
InChIKey HGVIAKXYAZRSEG-UHFFFAOYSA-N
SmilesC(NC1=CC=C(C)C=C1C)(=O)CC(=O)C
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MassMS-IW-5070 2',4'-dimethylacetoacetanilide C12H15NO2 (Mass of molecular ion: 205)
Source Temperature: 130 °C Sample Temperature: 100 °C Direct, 75 eV
39.0 1.8 41.0 1.1 43.0 14.2 51.0 1.4 52.0 1.1 53.0 1.2 65.0 2.0 77.0 6.5 78.0 1.8 79.0 1.9 85.0 3.1 91.0 5.3 92.0 1.4 93.0 1.9 103.0 1.9 104.0 1.5 105.0 1.8 106.0 21.9 107.0 2.3 118.0 3.7 119.0 5.1 120.0 31.5 121.0 100.0 122.0 10.1 132.0 2.6 146.0 1.6 147.0 40.5 148.0 5.2 205.0 40.7 206.0 5.6
KBr disc
nujol mull
