L-Isoleucine(73-32-5) Raman
Molecular FormulaC6H13NO2
Molecular Weight131.17
InChIInChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1
InChIKey AGPKZVBTJJNPAG-WHFBIAKZSA-N
SmilesC(O)(=O)[C@H]([C@@H](C)CC)N
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Mass
MS-NW-0627
L-isoleucine
C6H13NO2 (Mass of molecular ion: 131)
Source Temperature: 210 °C
Sample Temperature: 150 °C
Direct, 75 eV
15.0 1.3
17.0 1.0
18.0 9.0
26.0 1.3
27.0 10.4
28.0 29.1
29.0 27.0
30.0 42.1
39.0 7.7
41.0 26.5
42.0 3.8
43.0 3.6
44.0 15.0
45.0 2.0
46.0 6.6
53.0 1.5
54.0 2.3
55.0 2.9
56.0 11.5
57.0 41.5
58.0 6.3
69.0 13.6
70.0 4.7
74.0 31.8
75.0 44.6
76.0 1.8
84.0 1.3
86.0 100.0
87.0 6.2