Molecular Formula
Molecular Weight
InChI
InChIKey
Smiles
Mass
MS-IW-6806 (Z)-1-methyl-2-(4-nitrobenzoyl)-3-oxo-1-butenyl p-nitrobenzoate C19H14N2O8 (Mass of molecular ion: 398)
Source Temperature: 200 °C Sample Temperature: 200 °C Direct, 75 eV
15.0 1.5 17.0 1.0 18.0 5.2 27.0 2.1 28.0 4.3 30.0 6.4 37.0 1.0 38.0 2.1 39.0 6.7 43.0 54.1 44.0 2.2 45.0 1.2 50.0 12.5 51.0 6.8 53.0 2.9 55.0 1.0 62.0 2.0 63.0 4.5 64.0 3.6 65.0 25.2 66.0 3.4 67.0 1.5 69.0 1.2 73.0 1.0 74.0 5.7 75.0 12.1 76.0 21.7 77.0 3.7 81.0 2.9 85.0 2.5 87.0 1.0 88.0 1.4 89.0 1.3 92.0 9.9 93.0 3.8 102.0 1.0 103.0 3.3 104.0 28.7 105.0 2.9 109.0 9.4 113.0 1.9 114.0 2.3 115.0 2.8 120.0 10.2 121.0 17.3 122.0 2.3 127.0 1.2 128.0 1.9 134.0 1.5 137.0 5.6 143.0 1.3 150.0 100.0 151.0 9.2 152.0 1.1 156.0 1.0 167.0 31.6 168.0 3.0 170.0 2.5 184.0 8.6 185.0 2.6 189.0 22.1 190.0 4.0 192.0 6.0 202.0 1.8 206.0 1.0 207.0 1.3 214.0 15.9 215.0 2.3 216.0 7.0 230.0 4.4 231.0 17.3 232.0 10.9 233.0 1.4 234.0 2.7 248.0 1.0 249.0 1.5
KBr disc
nujol mull
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