DL-扁桃酸甲酯(4358-87-6)紅外圖譜(IR1)
InChI:InChI=1S/C9H10O3/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6,8,10H,1H3
InChIKey: ITATYELQCJRCCK-UHFFFAOYSA-N
Smiles:C(C1C=CC=CC=1)(O)C(=O)OC
-
Mass
MS-NW-1686
methyl DL-mandelate
C9H10O3 (Mass of molecular ion: 166)
Source Temperature: 240 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
15.0 5.5
27.0 2.5
28.0 1.2
29.0 3.7
39.0 3.2
50.0 3.4
51.0 10.1
52.0 2.5
53.0 1.7
59.0 1.1
63.0 1.7
77.0 28.2
78.0 5.0
79.0 54.9
80.0 3.7
89.0 1.1
90.0 1.0
105.0 6.3
106.0 2.0
107.0 100.0
108.0 8.0
166.0 9.7
167.0 1.0