Molecular Formula
Molecular Weight
InChI
InChIKey
Smiles
Mass
MS-IW-6749 (9R)-2'-oxo-1',2',3',4',10,11-hexahydrocinchonan-9-ol 9-acetate C21H28N2O3 (Mass of molecular ion: 356)
Source Temperature: 170 °C Sample Temperature: 150 °C Direct, 75 eV
27.0 1.1 28.0 1.9 29.0 2.4 30.0 4.4 39.0 1.6 41.0 8.1 42.0 8.7 43.0 12.9 44.0 3.7 53.0 1.5 54.0 1.3 55.0 13.9 56.0 5.0 57.0 1.8 65.0 1.1 67.0 2.9 68.0 2.3 69.0 2.9 70.0 4.2 71.0 1.4 72.0 3.1 77.0 3.3 79.0 1.2 80.0 1.7 81.0 2.2 82.0 9.3 83.0 4.2 84.0 5.1 86.0 2.3 90.0 1.1 91.0 3.0 93.0 1.1 94.0 1.5 95.0 2.3 96.0 3.1 97.0 1.6 98.0 1.4 103.0 1.5 106.0 1.2 108.0 9.2 109.0 2.2 110.0 100.0 111.0 9.4 112.0 2.6 113.0 2.0 117.0 3.1 118.0 2.5 122.0 3.0 123.0 1.5 124.0 3.3 126.0 1.7 128.0 16.0 129.0 2.0 130.0 4.5 136.0 1.7 138.0 10.2 139.0 2.0 140.0 1.3 144.0 1.2 145.0 1.4 146.0 24.3 147.0 3.5 148.5 1.2 150.0 2.0 151.0 6.7 152.0 10.5 153.0 1.3 154.0 1.1 159.0 1.4 160.0 1.0 168.0 31.5 169.0 4.2 170.0 1.5 171.0 1.2 172.0 2.1 182.0 5.2 183.0 1.2 184.0 2.1 185.0 1.8 196.0 2.6 197.0 1.1 198.0 1.0 199.0 2.9 210.0 9.1 211.0 54.4 212.0 8.0 213.0 1.9 214.0 1.3 239.0 5.4 240.0 1.3 241.0 2.9 242.0 1.2 253.0 1.0 255.0 1.0 267.0 7.0 268.0 2.2 273.0 1.3 295.0 2.0 296.0 15.1 297.0 42.9 298.0 9.0 299.0 1.1 313.0 1.1 356.0 4.4 357.0 1.8
KBr disc
nujol mull
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