4-BROMO-DL-PHENYLALANINE(14091-15-7) IR1
Molecular FormulaC9H10BrNO2
Molecular Weight244.09
InChIInChI=1S/C9H10BrNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
InChIKey PEMUHKUIQHFMTH-QMMMGPOBSA-N
SmilesC(O)(=O)[C@H](CC1=CC=C(Br)C=C1)N
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Mass
MS-NW-6897
4-bromo-DL-phenylalanine
C9H10BrNO2 (Mass of molecular ion: 243)
Source Temperature: 200 °C
Sample Temperature: 160 °C
Direct, 75 eV
18.0 3.6
28.0 10.8
29.0 1.0
30.0 1.3
39.0 2.7
42.0 1.7
43.0 1.6
46.0 4.6
50.0 1.9
51.0 2.3
58.5 3.7
59.5 5.1
62.0 1.1
63.0 3.0
64.0 1.2
65.0 2.1
74.0 100.0
75.0 3.8
76.0 1.3
77.0 1.0
89.0 5.3
90.0 7.5
91.0 6.8
92.0 1.2
102.0 1.1
117.0 2.0
118.0 3.5
119.0 9.4
120.0 1.0
169.0 10.5
170.0 5.1
171.0 10.5
172.0 5.1
197.0 1.2
198.0 5.8
199.0 1.6
200.0 5.6
243.0 2.2
245.0 2.2