3-ISOPROPYLPHENOL(618-45-1) IR1
Product Name3-ISOPROPYLPHENOL
CAS618-45-1
Molecular FormulaC9H12O
Molecular Weight136.19
InChIInChI=1S/C9H12O/c1-7(2)8-4-3-5-9(10)6-8/h3-7,10H,1-2H3
InChIKey VLJSLTNSFSOYQR-UHFFFAOYSA-N
SmilesC1(O)=CC=CC(C(C)C)=C1
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MassMS-NW-8906 m-isopropylphenol C9H12O (Mass of molecular ion: 136)
Source Temperature: 280 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 2.0 39.0 5.8 41.0 3.5 51.0 2.7 53.0 1.9 55.0 1.9 60.0 1.1 63.0 1.9 65.0 5.3 66.0 1.7 67.0 1.1 77.0 15.5 78.0 1.9 79.0 1.5 91.0 12.6 92.0 1.8 93.0 7.0 94.0 2.9 95.0 2.1 103.0 14.3 104.0 1.3 107.0 5.0 108.0 1.4 119.0 1.5 120.0 2.0 121.0 100.0 122.0 9.1 135.0 1.3 136.0 39.1 137.0 4.0
in CDCl3
liquid film
