4-(METHYLTHIO)-6-(HYDROXYMETHYL)-O-CRESOL(32867-65-5) IR2
Product Name4-(METHYLTHIO)-6-(HYDROXYMETHYL)-O-CRESOL
CAS32867-65-5
Molecular FormulaC9H12O2S
Molecular Weight184.26
InChIInChI=1S/C9H12O2S/c1-6-3-8(12-2)4-7(5-10)9(6)11/h3-4,10-11H,5H2,1-2H3
InChIKey KXBVWXBKFNILQH-UHFFFAOYSA-N
SmilesC1(CO)=CC(SC)=CC(C)=C1O
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MassMS-NW-8011 6-hydroxymethyl-4-methylthio-o-cresol C9H12O2S (Mass of molecular ion: 184)
Source Temperature: 160 °C Sample Temperature: 120 °C Direct, 75 eV
15.0 3.7 17.0 2.0 18.0 8.2 27.0 6.1 28.0 13.6 29.0 2.6 31.0 1.8 38.0 1.8 39.0 16.4 40.0 1.5 41.0 3.9 43.0 2.8 45.0 22.2 46.0 1.1 47.0 2.3 50.0 2.8 51.0 7.5 52.0 2.5 53.0 5.6 55.0 2.6 58.0 1.9 59.0 4.4 61.0 2.0 62.0 2.1 63.0 6.4 64.0 2.1 65.0 11.1 66.0 2.0 67.0 2.2 68.0 2.3 69.0 4.1 70.0 1.4 71.0 2.2 73.0 1.0 74.0 1.3 75.0 1.5 76.0 1.1 77.0 11.3 78.0 4.3 79.0 12.7 80.0 1.5 81.0 1.0 82.0 1.8 83.0 7.6 84.0 2.4 85.0 1.9 89.0 3.4 90.0 2.6 91.0 20.1 92.0 4.2 93.0 3.4 97.0 3.7 103.0 1.2 104.0 1.2 105.0 15.3 106.0 1.9 107.0 7.9 108.0 4.6 109.0 2.0 110.0 1.5 111.0 2.1 118.0 1.2 119.0 1.2 120.0 2.7 121.0 4.9 122.0 1.9 123.0 16.9 124.0 2.7 125.0 1.5 133.0 1.1 135.0 1.9 137.0 5.3 138.0 32.4 139.0 5.6 140.0 3.2 151.0 24.7 152.0 3.1 153.0 5.2 154.0 1.6 155.0 1.0 165.0 3.7 166.0 100.0 167.0 14.1 168.0 10.1 169.0 1.3 182.0 3.2 184.0 49.6 185.0 5.9 186.0 2.9
KBr disc
nujol mull
