Product NameL-Carnosine
CAS305-84-0
Molecular FormulaC9H14N4O3
Molecular Weight226.23
InChIInChI=1/C9H14N4O3/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)/t7-/s3
InChIKey CQOVPNPJLQNMDC-KPOCXSGKNA-N
Smiles[C@H](C(=O)O)(NC(=O)CCN)CC1N=CNC=1 |&1:0,r|
Mass
MS2003-02097WA N(alpha)-(beta-alanyl)-L-histidine C9H14N4O3 (Mass of molecular ion: 226)
Source Temperature: 250 °C Sample Temperature: 300 °C Direct, 70 eV comment: Pattern varies. middle period pattern is recorded.
16.0 2.2 17.0 3.0 18.0 6.2 26.0 1.0 27.0 4.5 28.0 14.6 29.0 1.4 30.0 21.7 36.0 2.2 39.0 3.2 40.0 2.0 41.0 3.6 42.0 4.7 43.0 4.0 44.0 10.0 45.0 1.3 52.0 2.9 53.0 2.4 54.0 14.3 55.0 12.6 56.0 5.5 57.0 1.0 60.0 1.0 66.0 2.7 67.0 1.5 68.0 3.0 69.0 2.8 70.0 2.4 72.0 8.4 74.0 1.9 80.0 1.6 81.0 65.1 82.0 100.0 83.0 17.3 84.0 1.3 89.0 22.2 90.0 1.2 92.0 1.2 93.0 10.6 94.0 28.5 95.0 13.0 96.0 2.2 99.0 2.0 107.0 3.1 108.0 4.9 109.0 10.4 110.0 98.4 111.0 10.1 112.0 1.5 119.0 1.3 120.0 8.8 121.0 6.0 122.0 5.2 128.0 2.1 134.0 2.3 135.0 1.2 136.0 5.9 137.0 2.0 138.0 12.2 139.0 8.6 140.0 21.4 141.0 1.7 146.0 3.1 152.0 1.8 153.0 1.5 154.0 3.0 155.0 1.9 156.0 5.5 162.0 1.2 163.0 1.0 164.0 6.4 165.0 3.5 166.0 2.5 179.0 1.7 180.0 1.8 181.0 15.1 182.0 8.0 183.0 1.5 190.0 2.3 191.0 1.2 197.0 3.5 208.0 3.5 209.0 5.8 210.0 1.5 226.0 8.5 227.0 1.2
KBr disc
nujol mull
L-Carnosine(305-84-0) IR1 Atlas of Related Products
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