2-Cyano-6-methoxybenzothiazole(943-03-3) IR1
Product Name2-Cyano-6-methoxybenzothiazole
CAS943-03-3
Molecular FormulaC9H6N2OS
Molecular Weight190.22
InChIInChI=1S/C9H6N2OS/c1-12-6-2-3-7-8(4-6)13-9(5-10)11-7/h2-4H,1H3
InChIKey DEWDWBYQOFXKIH-UHFFFAOYSA-N
SmilesS1C2=CC(OC)=CC=C2N=C1C#N
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MassMS-IW-6099 6-methoxy-2-benzothiazolecarbonitrile C9H6N2OS (Mass of molecular ion: 190)
Source Temperature: 130 °C Sample Temperature: 110 °C Direct, 75 eV
45.0 2.6 51.0 1.2 62.0 1.1 63.0 2.5 69.0 4.1 70.0 2.2 93.0 1.0 95.0 6.1 107.0 1.0 108.0 1.2 147.0 22.2 148.0 2.2 149.0 1.1 159.0 1.1 160.0 5.4 161.0 2.3 175.0 40.7 176.0 4.2 177.0 2.1 190.0 100.0 191.0 11.4 192.0 5.3
KBr disc
nujol mull
