4-Hexyn-2-ol(19780-83-7) 13C NMR
Product Name4-Hexyn-2-ol
CAS19780-83-7
Molecular FormulaC6H10O
Molecular Weight98.14
InChIInChI=1S/C6H10O/c1-3-4-5-6(2)7/h6-7H,5H2,1-2H3
InChIKey IKROQHVDACEGBA-UHFFFAOYSA-N
SmilesCC(O)CC#CC
parameter in CDCl3
-
1H NMR 300 MHz C6 H10 O 0.05 ml : 0.5 ml CDCl3 4-hexyn-2-ol 
Parameter ppm Hz
D(A) 3.910 D(C) 2.300 D(D) 1.804 D(E) 1.241 J(A,C) 5.5 J(A,D) 0. J(A,E) 6.1 J(C,D) 2.5 J(C,E) 0. J(D,E) 0. D(B) 3.81
Hz ppm Int.1187.71 3.959 21 1181.67 3.939 73 1176.12 3.920 145 1170.06 3.900 148 1164.48 3.882 78 1158.42 3.861 25 1143.03 3.810 90 696.54 2.322 87 694.02 2.313 254 691.50 2.305 292 688.54 2.295 281 686.03 2.287 256 683.53 2.278 94 543.70 1.812 530 541.20 1.804 1000 538.69 1.796 498 375.34 1.251 992 369.27 1.231 977
in CDCl3
liquid film
