4-tert-Butylphenol(98-54-4) IR2
Product Name4-tert-Butylphenol
CAS98-54-4
Molecular FormulaC10H14O
Molecular Weight150.22
InChIInChI=1S/C10H14O/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7,11H,1-3H3
InChIKey QHPQWRBYOIRBIT-UHFFFAOYSA-N
SmilesC1(O)=CC=C(C(C)(C)C)C=C1
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MassMS-NW-1815 p-tert-butylphenol C10H14O (Mass of molecular ion: 150)
Source Temperature: 260 °C Sample Temperature: 180 °C Reservoir, 75 eV
27.0 3.6 29.0 2.3 38.0 1.0 39.0 10.3 40.0 1.2 41.0 14.7 50.0 1.5 51.0 4.2 52.0 1.3 53.0 2.1 55.0 2.0 62.0 1.1 63.0 3.2 64.0 1.1 65.0 6.6 66.0 2.2 77.0 9.6 78.0 1.9 79.0 3.1 89.0 1.4 91.0 9.6 92.0 1.0 94.0 1.9 95.0 12.3 103.0 1.2 105.0 2.0 106.0 1.0 107.0 33.6 108.0 2.8 115.0 1.7 119.0 3.9 120.0 1.8 121.0 1.0 134.0 1.8 135.0 100.0 136.0 9.9 150.0 21.5 151.0 2.3
in CDCl3
CCl4 solution
KBr disc
nujol mull
4880 A,200 M,powder
