3-Aminobenzamide(3544-24-9) IR1
Product Name3-Aminobenzamide
CAS3544-24-9
Molecular FormulaC7H8N2O
Molecular Weight136.15
InChIInChI=1S/C7H8N2O/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H2,9,10)
InChIKey GSCPDZHWVNUUFI-UHFFFAOYSA-N
SmilesC(N)(=O)C1=CC=CC(N)=C1
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MassMS-NW-2073 m-aminobenzamide C7H8N2O (Mass of molecular ion: 136)
Source Temperature: 200 °C Sample Temperature: 190 °C Direct, 75 eV
17.0 1.6 18.0 7.8 27.0 2.1 28.0 7.4 37.0 3.2 38.0 6.8 39.0 19.4 40.0 3.0 41.0 7.5 42.0 1.9 44.0 5.4 45.5 1.2 46.0 1.6 50.0 3.1 51.0 3.1 52.0 6.8 53.0 2.2 54.0 3.5 61.0 1.8 62.0 3.5 63.0 9.9 64.0 10.3 65.0 42.4 66.0 10.2 67.0 1.6 74.0 1.0 75.0 1.3 76.0 1.9 78.0 1.0 80.0 3.1 90.0 4.4 91.0 21.1 92.0 70.4 93.0 6.8 107.0 1.9 108.0 1.2 117.0 2.1 118.0 42.2 119.0 5.9 120.0 64.1 121.0 5.1 136.0 100.0 137.0 8.9
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C7H8N2O 0.040 g : 0.5 ml DMSO-d6 m-aminobenzamide 
Assign. Shift(ppm)
A * 7.77 B * 7.19 C 7.08 D 7.07 E 7.009 F 6.701 G 5.21
Hz ppm Int.3104.62 7.766 368 2872.56 7.186 377 2834.23 7.090 526 2832.77 7.086 687 2830.82 7.081 978 2828.98 7.077 749 2826.79 7.071 1000 2818.97 7.052 693 2804.81 7.016 733 2797.12 6.997 399 2683.35 6.713 451 2682.13 6.709 436 2681.16 6.707 404 2676.52 6.695 363 2675.54 6.693 390 2674.32 6.690 393 2084.23 5.214 606
in D2O
in DMSO-d6
KBr disc
