2-Acetylbenzo[b]thiophene(22720-75-8) IR1
Product Name2-Acetylbenzo[b]thiophene
CAS22720-75-8
Molecular FormulaC10H8OS
Molecular Weight176.23
InChIInChI=1S/C10H8OS/c1-7(11)10-6-8-4-2-3-5-9(8)12-10/h2-6H,1H3
InChIKey SGSGCQGCVKWRNM-UHFFFAOYSA-N
SmilesC(=O)(C1SC2=CC=CC=C2C=1)C
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MassMS2016-05360CM 2-acetylbenzo(b)thiophene C10H8OS (Mass of molecular ion: 176)
Source Temperature: 250 °C Sample Temperature: 20 °C Direct, 70 eV
39.0 1.4 43.0 2.7 62.0 1.3 63.0 4.1 66.5 2.0 69.0 2.4 74.0 1.2 80.5 2.5 82.0 1.1 89.0 21.6 90.0 2.6 93.0 1.6 132.0 1.6 133.0 21.9 134.0 5.4 135.0 1.3 147.0 1.2 161.0 100.0 162.0 10.4 163.0 4.9 176.0 53.9 177.0 6.3 178.0 2.8
in CDCl3
in CDCl3
KBr disk
Nujol
