6-METHOXY-2-METHYLBENZOTHIAZOLE(2941-72-2) 1H NMR
Product Name6-METHOXY-2-METHYLBENZOTHIAZOLE
CAS2941-72-2
Molecular FormulaC9H9NOS
Molecular Weight179.24
InChIInChI=1S/C9H9NOS/c1-6-10-8-4-3-7(11-2)5-9(8)12-6/h3-5H,1-2H3
InChIKey DYHLJSUORLPGNT-UHFFFAOYSA-N
SmilesS1C2=CC(OC)=CC=C2N=C1C
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MassMS-NW-5613 6-methoxy-2-methylbenzothiazole C9H9NOS (Mass of molecular ion: 179)
Source Temperature: 270 °C Sample Temperature: 190 °C Reservoir, 75 eV
15.0 1.7 18.0 1.1 28.0 1.2 38.0 1.3 39.0 2.0 45.0 6.4 50.0 1.3 51.0 3.1 52.0 1.3 57.0 1.0 59.0 2.0 62.0 2.1 63.0 6.4 64.0 1.4 69.0 8.6 70.0 1.0 78.0 1.2 79.0 1.0 89.5 1.1 92.0 1.2 93.0 2.1 94.0 1.3 95.0 9.3 96.0 2.1 107.0 1.7 108.0 1.2 109.0 3.4 110.0 2.0 123.0 3.1 135.0 1.2 136.0 28.1 137.0 2.8 138.0 1.5 148.0 1.7 149.0 1.4 164.0 65.9 165.0 7.3 166.0 3.7 178.0 1.1 179.0 100.0 180.0 11.3 181.0 5.6
90 MHz in CDCl3
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1H NMR 89.56 MHz C9 H9 N O S 0.04 ml : 0.5 ml CDCl3 6-methoxy-2-methylbenzothiazole 
Assign. Shift(ppm)
A 7.812 B 7.268 C 7.033 D 3.846 E 2.775 J(A,B)=0.2HZ, J(A,C)=8.9HZ, J(B,C)=2.6HZ
Hz ppm Int.704.50 7.867 73 695.69 7.768 92 652.38 7.285 66 649.88 7.257 86 635.00 7.091 118 632.44 7.062 92 626.13 6.992 91 623.56 6.963 76 344.50 3.847 1000 248.63 2.777 691
in CDCl3
liquid film
