Molecular Formula
Molecular Weight
InChI
InChIKey
Smiles
Mass
MS-IW-4564 2-acetyl-3,7-dimethylbenzo(b)thiophene 2,4-dinitrophenylhydrazone C18H16N4O4S (Mass of molecular ion: 384)
Source Temperature: 170 °C Sample Temperature: 220 °C Direct, 75 eV
27.0 1.0 28.0 4.3 30.0 4.9 38.0 1.1 39.0 3.6 42.0 1.3 43.0 3.4 44.0 1.0 45.0 5.6 50.0 1.4 51.0 3.1 52.0 2.2 53.0 1.1 59.0 1.2 62.0 2.0 63.0 5.6 64.0 2.5 65.0 2.3 69.0 2.1 74.0 1.2 75.0 3.9 76.0 2.4 77.0 4.6 78.0 2.5 79.0 2.4 80.0 1.6 88.0 1.0 89.0 2.8 90.0 1.6 91.0 5.4 92.0 2.1 93.0 1.6 94.0 2.3 100.5 1.1 101.0 1.5 102.0 2.5 103.0 1.5 104.0 1.0 105.0 1.4 106.0 1.2 107.0 1.2 114.0 1.2 115.0 13.8 116.0 4.1 117.0 4.4 118.0 1.0 121.0 1.7 122.0 1.2 123.0 1.1 123.5 1.8 124.0 1.0 126.0 1.0 127.0 4.0 128.0 15.8 129.0 5.2 130.0 1.6 130.5 1.1 131.0 1.4 134.0 3.5 135.0 2.3 137.0 5.5 138.0 1.7 139.0 2.0 140.0 1.4 141.0 2.8 142.0 2.9 143.0 2.6 145.0 2.2 146.0 1.8 147.0 5.6 148.0 2.0 149.0 1.7 150.0 1.1 151.0 1.1 152.0 13.2 153.0 5.3 154.0 2.3 155.0 1.2 158.0 2.5 159.0 5.9 160.0 12.6 161.0 25.4 162.0 24.1 163.0 4.8 164.0 2.1 165.0 1.9 169.0 3.9 170.0 1.1 171.0 14.5 172.0 16.4 173.0 8.5 174.0 7.0 175.0 7.3 176.0 2.0 177.0 1.3 183.0 4.7 184.0 3.1 185.0 9.5 186.0 38.8 187.0 63.6 188.0 13.9 189.0 15.5 190.0 3.0 191.0 1.2 192.0 2.0 198.0 1.2 199.0 1.6 200.0 16.2 201.0 40.8 202.0 73.3 203.0 21.9 204.0 9.2 205.0 1.9 214.0 1.3 215.0 2.7 216.0 15.1 217.0 2.6 218.0 6.0 219.0 1.2 221.0 1.5 232.0 1.0 233.0 1.4 234.0 1.8 235.0 3.3 236.0 2.5 237.0 1.0 245.0 1.6 246.0 2.2 247.0 6.7 248.0 5.9 249.0 3.7 250.0 3.5 251.0 1.5 259.0 1.0 260.0 1.8 261.0 4.2 262.0 4.4 263.0 3.5 264.0 2.0 265.0 1.2 274.0 1.4 275.0 2.9 276.0 3.7 277.0 3.3 278.0 3.4 279.0 2.0 289.0 2.3 290.0 4.3 291.0 2.7 292.0 2.5 293.0 1.7 294.0 1.3 295.0 1.6 303.0 12.1 304.0 5.1 305.0 2.6 306.0 1.2 307.0 1.6 308.0 7.3 309.0 4.4 310.0 1.4 319.0 1.0 320.0 1.3 321.0 2.5 322.0 6.5 323.0 3.1 324.0 3.1 325.0 1.4 335.0 2.9 336.0 2.4 337.0 2.2 338.0 1.3 348.0 1.0 349.0 18.3 350.0 7.5 351.0 5.5 352.0 1.5 354.0 1.5 367.0 3.2 368.0 1.9 369.0 8.1 370.0 2.1 384.0 100.0 385.0 21.9 386.0 7.4 387.0 1.3
KBr disc
nujol mull
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