Product NameGlycylglycine
CAS556-50-3
Molecular FormulaC4H8N2O3
Molecular Weight132.12
InChIInChI=1S/C4H8N2O3/c5-1-3(7)6-2-4(8)9/h1-2,5H2,(H,6,7)(H,8,9)
InChIKey YMAWOPBAYDPSLA-UHFFFAOYSA-N
SmilesC(O)(=O)CNC(=O)CN
Mass
MS-NW-0236 glycylglycine C4H8N2O3 (Mass of molecular ion: 132)
Source Temperature: 210 °C Sample Temperature: 0 °C Direct, 75 eV
18.0 3.4 27.0 1.6 28.0 12.6 29.0 4.0 30.0 100.0 31.0 3.0 32.0 1.3 41.0 2.2 42.0 3.7 43.0 1.8 44.0 3.1 45.0 2.5 55.0 1.2 56.0 2.5 60.0 1.0 71.0 1.1 86.0 1.2 89.0 1.2 104.0 2.9 114.0 2.0 132.0 1.7
400 MHz in D2O
1H NMR | 399.65 MHz |
C4 H8 N2 O3 | 0.036 g : 0.5 ml D2O |
glycylglycine |
Assign. Shift(ppm) |
Hz ppm Int.
1548.71 3.876 794 1541.14 3.857 27 1537.11 3.847 22 1536.62 3.845 22 1536.13 3.844 21 1528.69 3.826 1000
in CDCl3
KBr disc
nujol mull
4880 A,200 M,powder
Glycylglycine(556-50-3) Raman Atlas of Related Products
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