Chloroacetyl-DL-norleucine(67206-26-2) IR1
Product NameChloroacetyl-DL-norleucine
CAS67206-26-2
Molecular FormulaC8H14ClNO3
Molecular Weight207.65
InChIInChI=1S/C8H14ClNO3/c1-2-3-4-6(8(12)13)10-7(11)5-9/h6H,2-5H2,1H3,(H,10,11)(H,12,13)/t6-/m0/s1
InChIKey NTOGPWIZAGBRID-LURJTMIESA-N
SmilesC(O)(=O)[C@H](CCCC)NC(CCl)=O
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MassMS-NW-1913 N-chloroacetyl-DL-norleucine C8H14ClNO3 (Mass of molecular ion: 207)
Source Temperature: 220 °C Sample Temperature: 140 °C Direct, 75 eV
14.0 1.4 15.0 5.2 18.0 4.4 26.0 2.2 27.0 25.7 28.0 39.1 29.0 28.1 30.0 52.5 31.0 3.0 35.0 1.2 36.0 8.4 38.0 2.7 39.0 13.8 40.0 2.5 41.0 43.7 42.0 17.4 43.0 32.9 44.0 14.6 45.0 4.3 46.0 2.5 49.0 20.0 51.0 6.5 53.0 2.7 54.0 3.7 55.0 11.2 56.0 19.5 57.0 12.7 58.0 2.3 59.0 1.3 60.0 1.1 67.0 2.9 68.0 3.0 69.0 30.5 70.0 11.7 71.0 1.4 73.0 6.4 74.0 34.8 75.0 1.7 76.0 1.7 77.0 16.5 78.0 1.1 79.0 5.4 81.0 1.1 82.0 1.1 83.0 1.3 84.0 10.0 85.0 1.9 86.0 94.0 87.0 5.7 88.0 1.7 94.0 16.7 96.0 6.8 97.0 1.6 98.0 5.5 99.0 4.1 105.0 2.2 106.0 24.5 107.0 1.6 108.0 7.9 112.0 2.9 113.0 1.0 114.0 6.8 115.0 3.7 118.0 1.1 119.0 4.9 120.0 4.5 121.0 1.8 122.0 1.4 126.0 2.2 127.0 3.7 128.0 10.1 130.0 7.2 132.0 2.3 133.0 23.8 134.0 1.9 135.0 7.9 146.0 3.2 148.0 1.0 150.0 1.8 151.0 18.4 152.0 1.5 153.0 6.0 154.0 2.2 158.0 7.4 161.0 1.6 162.0 100.0 163.0 9.1 164.0 32.5 165.0 3.1 172.0 5.8 189.0 1.9 207.0 1.3
in DMSO-d6
KBr disc
nujol mull
