Product NameGLYCYL-D-THREONINE DIHYDRATE
CAS74807-44-6
Molecular FormulaC6H16N2O6
Molecular Weight212.2
InChIInChI=1/C6H12N2O4.2H2O/c1-3(9)5(6(11)12)8-4(10)2-7;;/h3,5,9H,2,7H2,1H3,(H,8,10)(H,11,12);2*1H2/t3-,5+;;/s3
InChIKey BFDXCPYYJSKNOU-PMSOROBYNA-N
Smiles[C@H](C(=O)O)([C@@H](O)C)NC(=O)CN.O.O |&1:0,4,r|
Mass
MS-NW-1875 glycyl-D-threonine C6H12N2O4 (Mass of molecular ion: 176)
Source Temperature: 240 °C Sample Temperature: 240 °C Direct, 75 eV
15.0 3.3 16.0 2.9 17.0 4.9 18.0 23.5 19.0 1.4 26.0 1.3 27.0 5.0 28.0 17.6 29.0 9.0 30.0 25.7 31.0 2.0 39.0 2.0 40.0 1.0 41.0 2.7 42.0 9.7 43.0 7.7 44.0 38.2 45.0 25.3 46.0 1.7 52.0 1.5 53.0 1.0 54.0 5.1 55.0 5.2 56.0 8.2 57.0 41.7 58.0 5.0 59.0 3.5 67.0 1.2 68.0 2.1 69.0 2.5 70.0 1.1 71.0 3.2 72.0 1.5 73.0 1.8 74.0 1.2 75.0 1.8 83.0 1.5 84.0 1.0 85.0 7.1 86.0 6.4 113.0 1.6 114.0 100.0 115.0 7.2 128.0 6.9 140.0 5.3
KBr disc
nujol mull
4880 A,200 M,powder
GLYCYL-D-THREONINE DIHYDRATE(74807-44-6) Raman Atlas of Related Products