Product Name4-Hydroxy-3-pentanoyl-2H-chromen-2-one
CAS36953-87-4
Molecular FormulaC14H14O4
Molecular Weight246.26
InChI
InChIKey
Smiles
Mass
MS2003-01498WA 4-hydroxy-3-valerylcoumarin C14H14O4 (Mass of molecular ion: 246)
Source Temperature: 250 °C Sample Temperature: 35 °C Direct, 70 eV
27.0 2.8 29.0 5.4 39.0 3.7 41.0 5.2 43.0 2.3 50.0 1.1 51.0 3.9 53.0 1.1 55.0 3.4 57.0 8.5 63.0 3.5 64.0 3.0 65.0 6.4 69.0 1.9 76.0 1.7 77.0 9.2 79.0 1.2 85.0 2.0 89.0 3.4 92.0 8.0 93.0 6.6 105.0 3.9 117.0 1.1 120.0 14.1 121.0 38.8 122.0 3.0 147.0 1.0 152.0 1.2 161.0 1.9 162.0 21.2 163.0 5.0 189.0 83.4 190.0 9.5 191.0 1.5 199.0 3.6 200.0 1.0 204.0 67.8 205.0 8.1 206.0 1.0 213.0 1.4 217.0 100.0 218.0 14.3 219.0 1.8 228.0 1.4 229.0 2.2 231.0 1.3 246.0 28.1 247.0 6.7
KBr disc
nujol mull
4-Hydroxy-3-pentanoyl-2H-chromen-2-one(36953-87-4) IR1 Atlas of Related Products
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