Product Name2-Amino-6-chlorobenzothiazole
CAS95-24-9
Molecular FormulaC7H5ClN2S
Molecular Weight184.65
InChIInChI=1S/C7H5ClN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10)
InChIKey VMNXKIDUTPOHPO-UHFFFAOYSA-N
SmilesS1C2=CC(Cl)=CC=C2N=C1N
Mass
MS-IW-3632 6-chloro-2-benzothiazolamine C7H5ClN2S (Mass of molecular ion: 184)
Source Temperature: 150 °C Sample Temperature: 110 °C Direct, 75 eV
45.0 2.1 50.0 1.3 60.0 1.3 61.0 1.7 62.0 2.9 63.0 7.7 69.0 6.6 70.0 1.2 73.0 1.4 74.0 1.4 75.0 1.2 76.0 1.4 78.5 2.1 79.0 1.6 81.0 2.1 82.0 1.9 92.0 7.4 93.0 3.9 94.0 1.3 95.0 4.1 97.0 1.1 105.0 1.7 106.0 1.5 107.0 4.5 108.0 1.0 120.0 1.3 121.0 1.9 122.0 16.1 123.0 1.4 124.0 1.6 130.0 15.1 131.0 1.3 132.0 5.5 139.0 1.4 142.0 2.1 148.0 1.2 149.0 10.4 150.0 1.1 152.0 1.1 156.0 1.5 157.0 21.4 158.0 2.3 159.0 7.9 183.0 1.2 184.0 100.0 185.0 9.7 186.0 36.5 187.0 3.3 188.0 1.5
400 MHz in DMSO-d6
1H NMR | 399.65 MHz |
C7 H5 Cl N2 S | 0.035 g : 0.5 ml DMSO-d6 |
6-chloro-2-benzothiazolamine |
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Assign. Shift(ppm) |
Hz ppm Int.
3110.11 7.783 681 3108.03 7.777 674 3098.51 7.754 22 3098.14 7.753 22 3097.78 7.752 22 3069.46 7.681 22 3067.38 7.676 26 3053.10 7.640 1000 2931.76 7.336 440 2923.22 7.315 675 2895.39 7.245 434 2893.31 7.240 421 2886.84 7.224 285 2884.77 7.219 276
in DMSO-d6
KBr disc
nujol mull
2-Amino-6-chlorobenzothiazole (95-24-9) IR2 Atlas of Related Products
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