L-扁桃酸甲酯(21210-43-5)质谱(MS)
InChI:InChI=1/C9H10O3/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6,8,10H,1H3/t8-/s3
InChIKey: ITATYELQCJRCCK-SBYBRXNCNA-N
Smiles:C1(C=CC=CC=1)[C@H](O)C(=O)OC |&1:6,r|
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Mass
MS-NW-9230
(S)-(+)-methyl mandelate
C9H10O3 (Mass of molecular ion: 166)
Source Temperature: 250 °C
Sample Temperature: 160 °C
Reservoir, 75 eV
15.0 2.3
27.0 1.6
28.0 1.7
29.0 2.5
39.0 2.6
50.0 2.9
51.0 8.7
52.0 2.2
53.0 1.6
59.0 1.0
63.0 1.7
77.0 28.9
78.0 4.6
79.0 51.6
80.0 3.5
89.0 1.2
90.0 1.0
105.0 7.4
106.0 2.4
107.0 100.0
108.0 7.6
166.0 6.5