OCTOTIAMINE(137-86-0) MS
Molecular FormulaC23H36N4O5S3
Molecular Weight544.75
InChI
InChIKey
Smiles
-

Mass
MS-IW-4381
methyl 8-((2-(N-(4-amino-2-methyl-5-pyrimidinylmethyl)formamido)-1-(2-hydroxyethyl)-1-propenyl)dithio)-6-(acetylthio)octanoate
C23H36N4O5S3 (Mass of molecular ion: 546)
Source Temperature: 190 °C
Sample Temperature: 150 °C
Direct, 75 eV
18.0 2.0
39.0 1.3
50.0 2.3
51.0 9.3
52.0 1.7
63.0 1.8
69.5 2.9
70.0 1.9
75.0 1.4
76.0 4.8
77.0 26.1
78.0 9.8
81.0 1.4
81.5 3.0
82.0 10.3
82.5 9.0
83.0 6.8
89.0 1.2
90.0 5.5
90.5 1.2
103.0 1.7
104.0 37.4
104.5 2.1
105.0 4.9
115.0 1.1
130.0 1.4
132.0 1.3
139.0 1.8
147.0 10.2
148.0 1.0
151.0 1.2
152.0 2.9
153.0 1.5
163.0 2.5
164.0 3.7
165.0 22.4
166.0 5.1
175.0 5.2
179.0 1.2
180.0 100.0
181.0 26.7
182.0 3.1
205.0 1.1
208.0 21.4
209.0 76.6
210.0 11.7
211.0 1.0
223.0 54.8
224.0 11.2
225.0 1.1
252.0 79.0
253.0 14.1
254.0 1.5