DL-扁桃酸(611-72-3)質(zhì)譜(MS)
InChI:InChI=1S/C8H8O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7,9H,(H,10,11)
InChIKey: IWYDHOAUDWTVEP-UHFFFAOYSA-N
Smiles:C1(C=CC=CC=1)C(O)C(=O)O
-
Mass
MS-IW-2663
DL-mandelic acid
C8H8O3 (Mass of molecular ion: 152)
Source Temperature: 120 °C
Sample Temperature: 90 °C
Direct, 75 eV
18.0 4.1
27.0 1.1
28.0 1.1
29.0 1.5
39.0 2.3
45.0 1.0
50.0 3.3
51.0 8.2
52.0 1.9
53.0 1.7
63.0 1.5
74.0 1.0
77.0 28.7
78.0 4.5
79.0 45.2
80.0 3.1
89.0 1.5
90.0 3.0
105.0 4.9
106.0 1.6
107.0 100.0
108.0 8.6
152.0 19.3
153.0 1.7