5-acetyl-2-Furancarboxylic acid Methyl ester(13341-79-2) IR1
Product Name5-acetyl-2-Furancarboxylic acid Methyl ester
CAS13341-79-2
Molecular FormulaC8H8O4
Molecular Weight168.15
InChIInChI=1S/C8H8O4/c1-5(9)6-3-4-7(12-6)8(10)11-2/h3-4H,1-2H3
InChIKey GELBTJMNICDJKD-UHFFFAOYSA-N
SmilesO1C(C(C)=O)=CC=C1C(OC)=O
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MassMS-KW-0462 methyl 5-acetyl-2-furoate C8H8O4 (Mass of molecular ion: 168)
Source Temperature: 240 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 5.1 27.0 1.7 37.0 1.3 38.0 5.8 39.0 3.9 43.0 18.0 51.0 1.4 53.0 2.3 59.0 4.3 61.0 1.2 66.0 2.3 69.0 2.8 94.0 2.2 95.0 18.1 96.0 1.2 125.0 2.4 137.0 16.2 138.0 1.4 153.0 100.0 154.0 8.1 155.0 1.2 168.0 33.3 169.0 3.0
KBr disc
nujol mull
