Glycolic acid(79-14-1) MS
Product NameGlycolic acid
CAS79-14-1
Molecular FormulaC2H4O3
Molecular Weight76.05
InChIInChI=1S/C2H4O3/c3-1-2(4)5/h3H,1H2,(H,4,5)
InChIKey AEMRFAOFKBGASW-UHFFFAOYSA-N
SmilesC(O)(=O)CO
-
MassMS-NW-1669 glycolic acid C2H4O3 (Mass of molecular ion: 76)
Source Temperature: 240 °C Sample Temperature: 180 °C Reservoir, 75 eV
14.0 1.5 17.0 1.3 18.0 4.6 19.0 3.2 28.0 5.4 29.0 21.5 30.0 5.6 31.0 100.0 32.0 32.1 42.0 1.9 44.0 4.3 45.0 11.9 46.0 1.4 47.0 1.6 58.0 1.1 88.0 1.5
parameter in D2O
-
1H NMR 300 MHz C2 H4 O3 0.040 g : 0.5 ml D2O glycolic acid 
Parameter ppm Hz
D(A) 4.202
Hz ppm Int.1260.60 4.202 1000
in D2O
KBr disc
nujol mull
4880 A,200 M,powder
