2,2-二羥甲基丁酸(10097-02-6)紅外圖譜(IR2)
InChI:InChI=1S/C6H12O4/c1-2-6(3-7,4-8)5(9)10/h7-8H,2-4H2,1H3,(H,9,10)
InChIKey: JVYDLYGCSIHCMR-UHFFFAOYSA-N
Smiles:C(O)(=O)C(CO)(CO)CC
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Mass
MS-KW-0828
2,2-bis(hydroxymethyl)butyric acid
C6H12O4 (Mass of molecular ion: 148)
Source Temperature: 140 °C
Sample Temperature: 110 °C
Direct, 75 eV
15.0 1.1
18.0 2.3
19.0 1.7
26.0 1.0
27.0 11.9
28.0 6.1
29.0 17.6
31.0 13.7
39.0 9.3
40.0 1.7
41.0 16.9
42.0 2.2
43.0 11.9
44.0 2.5
45.0 7.9
47.0 1.4
53.0 5.9
54.0 10.7
55.0 48.3
56.0 11.7
57.0 15.8
58.0 3.4
60.0 1.0
67.0 1.6
68.0 1.2
69.0 3.7
70.0 1.1
71.0 4.4
72.0 4.9
73.0 3.4
81.0 1.4
82.0 34.6
83.0 15.1
84.0 3.8
85.0 34.1
86.0 3.1
97.0 1.2
99.0 9.6
100.0 100.0
101.0 12.8
102.0 3.1
112.0 9.2
117.0 2.1
118.0 19.5
119.0 1.1
131.0 1.0