Product Name3,5-DIMETHYL-2,6-BIS(METHYLTHIO)-4H-THIIN-4-ONE
Molecular FormulaC9H12OS3
Molecular Weight232.38598
InChI
InChIKey
Smiles
Mass
MS-IW-9406 3,5-dimethyl-2,6-bis(methylthio)-4H-thiin-4-one C9H12OS3 (Mass of molecular ion: 232)
Source Temperature: 130 °C Sample Temperature: 130 °C Direct, 75 eV
15.0 1.8 18.0 2.9 27.0 3.2 28.0 2.2 34.0 1.5 39.0 5.8 41.0 1.8 44.0 2.0 45.0 25.2 46.0 2.2 47.0 4.5 48.0 1.6 51.0 1.4 53.0 1.9 58.0 2.3 59.0 14.9 60.0 1.1 61.0 8.1 63.0 1.0 65.0 2.6 66.0 1.3 67.0 2.2 69.0 11.0 70.0 11.1 71.0 33.8 72.0 3.1 73.0 3.4 75.0 3.6 76.0 1.5 77.0 2.2 78.0 2.8 79.0 1.4 83.0 3.3 84.0 1.8 85.0 7.9 86.0 7.8 87.0 2.2 88.0 1.4 91.0 6.7 93.0 1.5 95.0 1.1 97.0 2.9 98.0 2.0 99.0 58.0 100.0 3.5 101.0 4.0 102.0 8.5 103.0 5.4 107.0 1.0 108.0 1.0 109.0 2.7 110.0 2.5 111.0 1.6 113.0 2.1 115.0 1.5 117.0 2.3 118.0 4.2 121.0 4.9 122.0 1.1 123.0 3.1 124.0 1.9 125.0 1.9 137.0 1.7 138.0 2.2 139.0 2.8 140.0 2.2 141.0 5.9 142.0 4.2 143.0 2.3 145.0 12.8 146.0 4.1 147.0 1.7 151.0 2.8 152.0 5.7 153.0 13.8 154.0 1.9 155.0 1.8 156.0 2.0 157.0 3.7 169.0 8.6 170.0 4.4 171.0 10.7 172.0 1.6 173.0 2.6 174.0 2.6 183.0 1.4 184.0 3.8 185.0 48.2 186.0 8.7 187.0 6.9 188.0 1.2 189.0 28.6 190.0 3.1 191.0 4.0 198.0 1.2 199.0 66.6 200.0 7.8 201.0 6.4 202.0 1.3 204.0 2.3 217.0 12.9 218.0 1.5 219.0 1.8 232.0 100.0 233.0 13.0 234.0 13.9 235.0 1.7
KBr disc
nujol mull
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