Butylated hydroxyanisole(25013-16-5) 1H NMR
Product NameButylated hydroxyanisole
CAS25013-16-5
Molecular FormulaC11H16O2
Molecular Weight180.24354
InChIInChI=1S/C7H8O2.C5H12/c1-9-7-4-2-6(8)3-5-7;1-5(2,3)4/h2-5,8H,1H3;1-4H3
InChIKey WYEIRNDSZQKIDQ-UHFFFAOYSA-N
SmilesC1C(OC)=CC=C(O)C=1.CC(C)(C)C
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MassMS-NW-8161 butylated hydroxyanisole C11H16O2 (Mass of molecular ion: 180)
Source Temperature: 120 °C Sample Temperature: 90 °C Direct, 75 eV
15.0 1.5 18.0 2.5 27.0 2.8 28.0 1.1 29.0 2.5 39.0 4.9 41.0 6.6 43.0 2.8 51.0 3.1 52.0 1.9 53.0 3.5 54.0 1.3 55.0 3.2 57.0 1.5 63.0 1.4 65.0 3.2 66.0 1.0 67.0 1.5 68.5 1.2 76.0 1.1 77.0 6.3 78.0 2.6 79.0 3.1 81.0 1.0 82.5 2.2 91.0 6.6 93.0 1.4 94.0 1.1 103.0 2.0 104.0 1.3 105.0 2.9 107.0 3.3 108.0 1.1 109.0 2.5 110.0 1.5 115.0 3.0 116.0 1.2 117.0 1.0 121.0 2.2 122.0 1.8 123.0 1.3 124.0 5.4 125.0 3.7 131.0 1.5 132.0 1.2 133.0 1.7 135.0 1.1 137.0 42.6 138.0 3.9 149.0 3.3 150.0 3.4 151.0 1.1 164.0 1.0 165.0 100.0 166.0 11.0 167.0 1.0 180.0 71.2 181.0 8.7
KBr disc
