5-溴-4-氯-3-吲哚半乳糖苷(7240-90-6)Raman光譜
分子式:C14H15BrClNO6
分子量: 408.63
InChI:InChI=1/C14H15BrClNO6/c15-5-1-2-6-9(10(5)16)7(3-17-6)22-14-13(21)12(20)11(19)8(4-18)23-14/h1-3,8,11-14,17-21H,4H2/t8-,11+,12+,13-,14-/s3
InChIKey: OPIFSICVWOWJMJ-CEPRPRRCNA-N
Smiles:O([C@H]1[C@@H]([C@@H](O)[C@@H](O)[C@@H](CO)O1)O)C1=CNC2=CC=C(Br)C(Cl)=C12 |&1:1,2,3,5,7,r|
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Mass
MS-IW-2397
5-bromo-4-chloro-3-indolyl beta-D-galactopyranoside
C14H15BrClNO6 (Mass of molecular ion: 407)
Source Temperature: 170 °C
Sample Temperature: 170 °C
Direct, 75 eV
18.0 2.5
19.0 1.7
27.0 1.6
28.0 4.4
29.0 3.5
31.0 4.3
41.0 2.1
42.0 1.3
43.0 5.8
44.0 1.1
45.0 4.0
55.0 1.7
56.0 1.1
57.0 5.4
60.0 4.0
61.0 4.1
69.0 3.2
70.0 1.0
71.0 2.6
73.0 10.2
74.0 3.4
75.0 3.3
76.0 1.6
85.0 3.6
87.0 1.8
91.0 3.8
97.0 1.6
101.0 1.1
102.0 3.1
103.0 1.7
109.0 1.3
110.0 1.1
111.0 2.0
130.0 4.8
131.0 1.1
137.0 1.1
138.0 1.4
165.0 1.7
166.0 5.1
167.0 2.8
168.0 1.8
190.0 1.0
191.0 1.1
209.0 1.7
211.0 2.3
216.0 1.9
217.0 1.9
218.0 2.6
219.0 2.3
244.0 3.2
245.0 77.3
246.0 11.2
247.0 100.0
248.0 10.4
249.0 24.5
250.0 2.3
258.0 1.0
260.0 1.2