Acetylleucine(99-15-0) MS
Product NameAcetylleucine
CAS99-15-0
Molecular FormulaC8H15NO3
Molecular Weight173.21
InChIInChI=1S/C8H15NO3/c1-5(2)4-7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t7-/m0/s1
InChIKey WXNXCEHXYPACJF-ZETCQYMHSA-N
SmilesC(O)(=O)[C@H](CC(C)C)NC(C)=O
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MassMS-NW-1916 N-acetyl-DL-leucine C8H15NO3 (Mass of molecular ion: 173)
Source Temperature: 210 °C Sample Temperature: 140 °C Direct, 75 eV
14.0 1.0 15.0 11.5 17.0 2.4 18.0 11.5 26.0 1.1 27.0 12.9 28.0 14.1 29.0 10.1 30.0 37.7 39.0 8.8 40.0 1.9 41.0 20.9 42.0 13.7 43.0 94.2 44.0 41.4 45.0 1.6 46.0 1.2 53.0 1.9 54.0 1.2 55.0 3.2 56.0 3.8 57.0 14.1 58.0 1.0 59.0 2.1 60.0 11.1 67.0 1.3 68.0 12.2 69.0 4.3 70.0 18.9 71.0 5.5 72.0 2.3 73.0 1.9 74.0 21.1 75.0 4.4 84.0 4.5 85.0 21.9 86.0 100.0 87.0 5.9 88.0 5.4 96.0 3.2 97.0 1.0 99.0 39.5 100.0 2.0 112.0 9.3 113.0 3.9 114.0 3.1 116.0 3.8 117.0 27.2 118.0 1.4 127.0 1.9 128.0 39.7 129.0 5.2 130.0 3.8 158.0 1.0 173.0 2.0
KBr disc
nujol mull
