2-Thiopheneethanol(5402-55-1) 13C NMR
Product Name2-Thiopheneethanol
CAS5402-55-1
Molecular FormulaC6H8OS
Molecular Weight128.19
InChIInChI=1S/C6H8OS/c7-4-3-6-2-1-5-8-6/h1-2,5,7H,3-4H2
InChIKey VMJOFTHFJMLIKL-UHFFFAOYSA-N
SmilesC1(CCO)SC=CC=1
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MassMS-NW-5586 2-(2-thienyl)ethanol C6H8OS (Mass of molecular ion: 128)
Source Temperature: 270 °C Sample Temperature: 190 °C Reservoir, 75 eV
27.0 2.0 29.0 1.0 31.0 3.3 38.0 1.1 39.0 5.2 45.0 12.2 47.0 1.0 50.0 1.0 51.0 1.7 53.0 8.1 58.0 2.1 59.0 1.1 63.0 1.4 65.0 2.2 69.0 2.5 71.0 1.4 84.0 1.0 97.0 100.0 98.0 15.2 99.0 5.7 110.0 1.1 128.0 32.1 129.0 2.4 130.0 1.5
90 MHz in CDCl3
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1H NMR 89.56 MHz C6 H8 O S 0.04 ml : 0.5 ml CDCl3 2-(2-thienyl)ethanol 
Assign. Shift(ppm)
A 7.142 B 6.937 C 6.86 D 3.814 E 3.051 F 2.02 J(A,B)=5.0HZ. J(A,C)=1.4HZ.
Hz ppm Int.643.63 7.187 314 642.25 7.172 298 638.63 7.131 595 637.25 7.116 582 625.69 6.987 262 622.25 6.948 493 620.69 6.931 117 617.25 6.893 416 616.69 6.886 218 615.81 6.876 365 615.25 6.870 275 614.44 6.861 353 613.63 6.852 180 612.44 6.839 174 611.56 6.829 119 611.06 6.823 132 610.25 6.814 71 348.88 3.896 361 348.25 3.889 342 342.50 3.825 674 341.94 3.818 1000 336.13 3.754 527 335.69 3.749 493 279.19 3.118 334 273.44 3.054 442 272.81 3.047 584 267.13 2.983 168 266.50 2.976 255 179.88 2.009 974
in CDCl3
liquid film
