蓖麻油酸(141-22-0)核磁圖(13CNMR)
InChI:InChI=1S/C18H34O3/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21/h9,12,17,19H,2-8,10-11,13-16H2,1H3,(H,20,21)/b12-9-/t17-/m1/s1
InChIKey: WBHHMMIMDMUBKC-QJWNTBNXSA-N
Smiles:C(O)(=O)CCCCCCC/C=C\C[C@H](O)CCCCCC
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Mass
MS-NW-8905
(R-(Z))-12-hydroxy-9-octadecenoic acid
C18H34O3 (Mass of molecular ion: 298)
Source Temperature: 210 °C
Sample Temperature: 130 °C
Direct, 75 eV
17.0 2.6
18.0 14.4
27.0 3.3
28.0 3.0
29.0 9.6
31.0 1.6
39.0 3.7
41.0 29.9
42.0 5.3
43.0 31.2
44.0 3.3
45.0 3.6
53.0 3.4
54.0 17.3
55.0 100.0
56.0 14.6
57.0 15.4
58.0 2.3
59.0 2.0
60.0 6.7
61.0 1.3
65.0 1.4
66.0 2.6
67.0 35.6
68.0 29.7
69.0 45.3
70.0 13.1
71.0 9.4
73.0 11.9
74.0 1.2
77.0 2.0
78.0 1.3
79.0 9.7
80.0 7.9
81.0 34.5
82.0 41.7
83.0 31.0
84.0 38.1
85.0 7.9
86.0 1.2
87.0 5.3
88.0 1.7
91.0 2.8
92.0 1.4
93.0 6.4
94.0 9.2
95.0 25.1
96.0 38.6
97.0 49.9
98.0 61.5
99.0 6.7
100.0 5.7
101.0 7.1
102.0 2.8
105.0 1.7
106.0 2.6
107.0 4.2
108.0 7.2
109.0 14.0
110.0 19.1
111.0 14.8
112.0 7.2
113.0 5.3
114.0 12.2
115.0 6.6
116.0 2.5
119.0 6.3
120.0 1.7
121.0 3.1
122.0 15.3
123.0 17.7
124.0 26.2
125.0 9.1
126.0 1.8
127.0 5.0
128.0 1.8
129.0 2.2
133.0 3.1
135.0 3.3
136.0 2.8
137.0 14.3
138.0 6.7
139.0 2.0
140.0 1.4
141.0 3.4
147.0 1.1
148.0 16.5
149.0 4.5
150.0 2.6
151.0 3.9
152.0 1.9
153.0 1.2
154.0 1.2
155.0 2.8
164.0 1.4
165.0 1.8
166.0 31.6
167.0 5.3
168.0 1.8
182.0 2.5
184.0 11.4
185.0 2.2
195.0 3.9
196.0 1.4
264.0 1.2
280.0 8.4
281.0 2.5