ISOBUTYL BENZOATE(120-50-3) Raman
Molecular FormulaC11H14O2
Molecular Weight178.23
InChIInChI=1S/C11H14O2/c1-9(2)8-13-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey KYZHGEFMXZOSJN-UHFFFAOYSA-N
SmilesC(OCC(C)C)(=O)C1=CC=CC=C1
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Mass
MS-NW-0931
isobutyl benzoate
C11H14O2 (Mass of molecular ion: 178)
Source Temperature: 280 °C
Sample Temperature: 150 °C
Reservoir, 75 eV
18.0 1.2
27.0 3.2
28.0 3.0
29.0 4.1
39.0 3.6
41.0 7.6
43.0 1.6
50.0 3.6
51.0 12.5
55.0 1.3
56.0 27.5
57.0 2.3
73.0 1.1
76.0 2.1
77.0 35.7
78.0 2.9
79.0 2.4
105.0 100.0
106.0 8.3
122.0 2.0
123.0 40.9
124.0 3.3