HYDANTOIC ACID(462-60-2) IR2
Molecular FormulaC3H6N2O3
Molecular Weight118.09
InChIInChI=1S/C3H6N2O3/c4-3(8)5-1-2(6)7/h1H2,(H,6,7)(H3,4,5,8)
InChIKey KZVRXPPUJQRGFN-UHFFFAOYSA-N
SmilesC(O)(=O)CNC(N)=O
-

Mass
MS-NW-0414
hydantoic acid
C3H6N2O3 (Mass of molecular ion: 118)
Source Temperature: 200 °C
Sample Temperature: 180 °C
Direct, 75 eV
16.0 5.9
17.0 8.4
18.0 2.8
27.0 4.5
28.0 29.2
29.0 21.8
30.0 100.0
31.0 3.3
42.0 4.7
43.0 18.3
44.0 18.8
45.0 4.7
56.0 7.0
57.0 7.2
72.0 1.6
73.0 41.1
74.0 11.6
75.0 5.9
100.0 4.6
101.0 5.5
118.0 1.7
90 MHz in D2O
parameter in D2O