产品名称 乙醇酸
CAS号79-14-1
分子式C2H4O3
分子量76.05
InChIInChI=1S/C2H4O3/c3-1-2(4)5/h3H,1H2,(H,4,5)
InChIKeyAEMRFAOFKBGASW-UHFFFAOYSA-N
SmilesC(O)(=O)CO
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Mass
MS-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
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
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