Product Name7-OXO-4-PHENYLHEXAHYDRO-4-AZEPINECARBONITRILE
Molecular FormulaC13H14N2O
Molecular Weight214.26306
InChI
InChIKey
Smiles
Mass
MS-IW-7183 7-oxo-4-phenylhexahydro-4-azepinecarbonitrile C13H14N2O (Mass of molecular ion: 214)
Source Temperature: 170 °C Sample Temperature: 160 °C Direct, 75 eV
17.0 2.6 18.0 13.8 26.0 2.9 27.0 16.3 28.0 10.5 29.0 1.9 30.0 41.5 38.0 1.2 39.0 7.3 40.0 1.4 41.0 3.3 42.0 3.2 43.0 7.6 44.0 26.2 45.0 1.6 50.0 4.2 51.0 11.7 52.0 4.6 53.0 4.0 54.0 2.0 55.0 21.0 56.0 10.2 57.0 11.1 57.5 2.0 58.0 1.2 62.0 2.2 63.0 6.4 64.0 3.2 65.0 5.8 66.0 1.4 67.0 2.5 68.0 1.2 70.0 2.5 70.5 3.0 71.0 1.9 71.5 1.8 72.0 1.9 74.0 1.9 75.0 3.0 76.0 4.5 77.0 13.4 78.0 7.4 79.0 1.5 80.0 1.0 81.0 1.6 82.0 1.6 83.5 3.3 84.0 16.8 84.5 1.7 85.0 45.9 86.0 2.8 87.0 1.4 88.0 2.1 89.0 6.7 90.0 2.4 91.0 12.2 92.0 1.8 93.0 1.5 94.0 2.3 97.0 2.0 101.0 2.5 102.0 10.5 103.0 18.0 104.0 4.2 105.0 2.5 106.0 30.1 107.0 2.9 108.0 2.3 109.0 1.7 113.0 1.7 114.0 3.1 115.0 34.8 116.0 24.3 117.0 10.3 118.0 3.5 119.0 1.5 126.0 1.1 127.0 4.8 128.0 13.5 129.0 78.8 130.0 18.9 131.0 4.0 132.0 3.2 136.0 1.5 137.0 1.1 139.0 3.0 140.0 6.9 141.0 14.5 142.0 23.8 143.0 39.1 144.0 8.1 145.0 3.2 146.0 3.3 152.0 2.2 153.0 2.2 154.0 6.7 155.0 3.0 156.0 3.2 157.0 6.1 158.0 5.1 159.0 4.4 160.0 2.9 166.0 2.5 167.0 10.9 168.0 21.3 169.0 35.8 170.0 6.2 171.0 2.7 172.0 9.3 173.0 1.9 184.0 2.2 185.0 11.1 186.0 29.1 187.0 6.4 196.0 2.1 213.0 2.6 214.0 100.0 215.0 15.9 216.0 1.4 239.0 1.0
KBr disc
nujol mull
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