2-Chloropropane(75-29-6) 1H NMR
Product Name2-Chloropropane
CAS75-29-6
Molecular FormulaC3H7Cl
Molecular Weight78.54
InChIInChI=1S/C3H7Cl/c1-3(2)4/h3H,1-2H3
InChIKey ULYZAYCEDJDHCC-UHFFFAOYSA-N
SmilesCC(Cl)C
-
MassMS-NW-4938 2-chloropropane C3H7Cl (Mass of molecular ion: 78)
Source Temperature: 260 °C Sample Temperature: 180 °C Reservoir, 75 eV
15.0 1.7 26.0 2.4 27.0 29.3 36.0 1.2 37.0 1.5 38.0 2.4 39.0 8.5 40.0 2.1 41.0 21.8 42.0 6.6 43.0 100.0 44.0 3.6 62.0 1.8 63.0 17.0 65.0 5.7 78.0 9.0 80.0 3.1
parameter in benzene
-
1H NMR 300 MHz C3 H7 Cl infinite dilution in benzene 2-chloropropane 
Parameter ppm Hz
D(A) 3.735 D(B) 1.144 J(A,B) 6.48 SCHRUMPF,G. TETRAHEDRON LETT. 33, 3421 (1972)
Hz ppm Int.1133.53 3.778 30 1127.06 3.757 74 1120.58 3.735 100 1114.11 3.714 77 1107.61 3.692 32 346.45 1.155 1000 339.95 1.133 978
in CDCl3
liquid film
4880 A,200 M,liquid
