Product Namehomocarnosine sulphate
CAS19841-48-6
Molecular FormulaC10H18N4O7S
Molecular Weight338.33752
InChIInChI=1S/C10H16N4O3.H2O4S/c11-3-1-2-9(15)14-8(10(16)17)4-7-5-12-6-13-7;1-5(2,3)4/h5-6,8H,1-4,11H2,(H,12,13)(H,14,15)(H,16,17);(H2,1,2,3,4)
InChIKey YQJJBZFOWMESSQ-UHFFFAOYSA-N
SmilesC(O)(=O)C(NC(=O)CCCN)CC1NC=NC=1.S(O)(O)(=O)=O
Mass
MS-IW-2414 N(alpha)-(4-aminobutyryl)-L-histidine sulfate C10H16N4O3 H2O4S (Mass of molecular ion: 240)
Source Temperature: 180 °C Sample Temperature: 220 °C Direct, 75 eV
26.0 1.1 27.0 3.4 28.0 13.0 30.0 2.0 32.0 2.8 33.0 1.0 34.0 2.7 38.0 1.2 39.0 6.0 40.0 4.1 41.0 17.2 42.0 4.2 43.0 1.2 44.0 7.2 48.0 6.4 52.0 2.7 53.0 1.9 54.0 6.1 55.0 2.6 56.0 2.0 60.0 2.6 64.0 18.3 66.0 2.6 67.0 3.0 68.0 10.4 69.0 8.5 70.0 1.0 76.0 3.2 80.0 1.7 81.0 72.5 82.0 9.6 83.0 1.5 84.0 1.9 85.0 3.3 93.0 2.4 94.0 2.3 95.0 5.0 96.0 3.2 106.0 4.7 107.0 3.0 108.0 3.3 109.0 1.4 120.0 1.5 121.0 1.3 123.0 3.3 124.0 100.0 125.0 7.3 134.0 1.7 136.0 1.2 146.0 1.6 147.0 1.2 160.0 1.0 174.0 3.7 175.0 3.1 176.0 2.4 202.0 12.4 203.0 3.2 204.0 36.3 205.0 4.6
KBr disc
nujol mull
homocarnosine sulphate(19841-48-6) IR2 Atlas of Related Products
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