D-(-)-Asparagine monohydrate(2058-58-4) IR1
Product NameD-(-)-Asparagine monohydrate
CAS2058-58-4
Molecular FormulaC4H8N2O3
Molecular Weight132.12
InChIInChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m1/s1
InChIKey DCXYFEDJOCDNAF-UWTATZPHSA-N
SmilesC(O)(=O)[C@@H](CC(N)=O)N
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MassMS-NW-4969 D-asparagine C4H8N2O3 H2O (Mass of molecular ion: 132)
Source Temperature: 210 °C Sample Temperature: 150 °C Direct, 75 eV
14.0 1.4 15.0 8.0 16.0 4.8 17.0 8.2 18.0 28.6 26.0 2.0 27.0 5.2 28.0 23.4 29.0 2.3 30.0 8.8 40.0 3.0 41.0 7.5 42.0 25.4 43.0 31.8 44.0 68.4 45.0 7.9 46.0 3.5 55.0 2.6 59.0 15.7 60.0 2.4 69.0 1.7 70.0 25.8 71.0 2.0 72.0 1.0 74.0 5.7 86.0 9.2 87.0 100.0 88.0 5.7 114.0 5.1 115.0 2.2
in D2O
KBr disc
nujol mull
