Molecular FormulaC16H15NO2S
Molecular Weight285.3608
InChIInChI=1S/C16H15NO2S/c1-12-3-5-13(6-4-12)11-17-20-16(18)14-7-9-15(19-2)10-8-14/h3-11H,1-2H3/b17-11+
InChIKey FGGPSICPCPZRHR-GZTJUZNOSA-N
SmilesN(=C/C1=CC=C(C)C=C1)\SC(=O)C1=CC=C(OC)C=C1
Mass
MS-NW-7305 S-(p-methoxybenzoyl)-N-(p-methylbenzylidene)thiohydroxylamine C16H15NO2S (Mass of molecular ion: 285)
Source Temperature: 180 °C Sample Temperature: 150 °C Direct, 75 eV
38.0 1.8 39.0 4.3 45.0 2.5 50.0 2.7 51.0 2.7 62.0 1.1 63.0 5.3 64.0 6.4 65.0 3.4 76.0 1.7 77.0 16.8 78.0 1.7 79.0 2.0 89.0 2.1 90.0 1.5 91.0 2.4 92.0 10.4 107.0 7.1 116.0 1.9 117.0 2.6 118.0 1.5 135.0 100.0 136.0 8.8
400 MHz in CDCl3
1H NMR | 399.65 MHz |
C16 H15 N O2 S | 0.018 g : 0.5 ml CDCl3 |
S-(p-methoxybenzoyl)-N-(p-methylbenzylidene)thiohydroxylamine |
Assign. Shift(ppm) |
Hz ppm Int.
3499.02 8.756 206 3171.02 7.935 228 3168.82 7.929 68 3164.06 7.918 70 3161.99 7.912 246 3159.18 7.905 30 3093.02 7.740 138 3091.31 7.736 53 3086.30 7.723 50 3084.72 7.719 154 2902.83 7.264 646 2900.02 7.257 125 2892.09 7.237 111 2787.11 6.974 219 2784.91 6.969 67 2780.15 6.957 69 2779.17 6.955 81 2778.08 6.952 219 2775.15 6.944 30 1548.46 3.875 1000 957.64 2.397 437
in CDCl3
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