Product Nameε-Caprolactone
CAS502-44-3
Molecular FormulaC6H10O2
Molecular Weight114.14
InChIInChI=1S/C6H10O2/c7-6-4-2-1-3-5-8-6/h1-5H2
InChIKey PAPBSGBWRJIAAV-UHFFFAOYSA-N
SmilesO1CCCCCC1=O
Mass
MS-NW-0859 6-hexanolide C6H10O2 (Mass of molecular ion: 114)
Source Temperature: 280 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 2.2 26.0 4.8 27.0 22.7 28.0 26.4 29.0 13.7 31.0 1.9 38.0 2.4 39.0 21.0 40.0 6.8 41.0 49.9 42.0 100.0 43.0 5.0 44.0 1.4 50.0 1.2 51.0 1.4 53.0 3.1 54.0 1.8 55.0 96.6 56.0 30.2 57.0 4.7 67.0 4.1 68.0 2.0 69.0 1.1 70.0 21.4 71.0 1.3 83.0 1.9 84.0 44.1 85.0 3.2 114.0 20.9 115.0 1.6
in CDCl3
CCl4 solution
KBr disc
liquid film
nujol mull
ε-Caprolactone(502-44-3) 13C NMR Atlas of Related Products
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