2,2-PENTAMETHYLENE-1,3-DIOXOLAN-4-ONE(4423-79-4) IR1
Product Name2,2-PENTAMETHYLENE-1,3-DIOXOLAN-4-ONE
CAS4423-79-4
Molecular FormulaC8H12O3
Molecular Weight156.18
InChIInChI=1S/C8H12O3/c9-7-6-10-8(11-7)4-2-1-3-5-8/h1-6H2
InChIKey HBGAMCTZOLJGAS-UHFFFAOYSA-N
SmilesO1C2(CCCCC2)OCC1=O
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MassMS-NW-8750 1,4-dioxaspiro(4.5)decane-2-one C8H12O3 (Mass of molecular ion: 156)
Source Temperature: 260 °C Sample Temperature: 140 °C Reservoir, 75 eV
15.0 1.1 26.0 1.3 27.0 12.3 28.0 7.6 29.0 6.4 31.0 1.6 39.0 15.8 40.0 4.0 41.0 28.2 42.0 48.8 43.0 19.6 44.0 1.6 45.0 2.3 51.0 1.6 52.0 1.0 53.0 4.0 54.0 12.1 55.0 100.0 56.0 14.6 57.0 2.1 67.0 7.0 68.0 1.9 69.0 40.9 70.0 31.0 71.0 2.5 72.0 2.6 79.0 2.3 80.0 20.3 81.0 4.3 83.0 11.9 84.0 5.6 85.0 13.5 97.0 7.4 98.0 98.9 99.0 7.6 100.0 2.8 111.0 2.2 112.0 4.7 113.0 64.7 114.0 3.9 126.0 5.3 127.0 8.3 128.0 2.1 156.0 27.1 157.0 2.9
in CDCl3
liquid film
