3,3-BIS(CHLOROMETHYL)OXETANE(78-71-7) MS
Product Name3,3-BIS(CHLOROMETHYL)OXETANE
CAS78-71-7
Molecular FormulaC5H8Cl2O
Molecular Weight155.02
InChIInChI=1S/C5H8Cl2O/c6-1-5(2-7)3-8-4-5/h1-4H2
InChIKey CXURGFRDGROIKG-UHFFFAOYSA-N
SmilesO1CC(CCl)(CCl)C1
-
MassMS-IW-9180 3,3-bis(chloromethyl)oxetane C5H8Cl2O (Mass of molecular ion: 154)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 1.0 26.0 2.6 27.0 18.1 28.0 4.8 29.0 7.4 30.0 2.3 31.0 2.4 35.0 1.1 36.0 5.7 37.0 2.2 38.0 3.8 39.0 23.4 40.0 3.2 41.0 4.8 49.0 9.2 50.0 3.2 51.0 9.6 52.0 4.2 53.0 69.1 54.0 4.6 55.0 1.9 61.0 2.0 62.0 8.3 63.0 2.4 64.0 3.2 73.0 1.7 75.0 18.5 77.0 5.7 82.0 1.2 83.0 1.7 87.0 2.1 88.0 100.0 89.0 51.5 90.0 34.0 91.0 16.2 109.0 1.2 124.0 20.8 125.0 1.4 126.0 13.3 128.0 2.3 136.0 1.4
parameter in CDCl3
-
1H NMR 300 MHz C5 H8 Cl2 O 0.05 ml : 0.5 ml CDCl3 3,3-bis(chloromethyl)oxetane 
Parameter ppm Hz
D(A) 4.452 D(B) 3.949
Hz ppm Int.1335.60 4.452 1000 1184.70 3.949 1000
in CDCl3
liquid film
