5-Phenyltetrazole(18039-42-4) 1H NMR
Product Name5-Phenyltetrazole
CAS18039-42-4
Molecular FormulaC7H6N4
Molecular Weight146.15
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MassMS-IW-9673 1-phenyl-1H-tetrazole C7H6N4 (Mass of molecular ion: 146)
Source Temperature: 140 °C Sample Temperature: 130 °C Direct, 75 eV
26.0 1.2 27.0 4.0 28.0 7.2 37.0 4.3 38.0 9.4 39.0 11.5 40.0 2.3 41.0 6.4 45.5 1.3 49.0 1.1 50.0 9.2 51.0 23.0 52.0 5.9 61.0 1.7 62.0 3.4 63.0 13.6 64.0 34.0 65.0 8.8 66.0 1.4 74.0 2.6 75.0 1.6 76.0 1.7 77.0 45.6 78.0 4.8 90.0 2.5 91.0 74.4 92.0 5.8 118.0 100.0 119.0 8.7 146.0 5.7 147.0 1.9
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C7 H6 N4 0.032 g : 0.5 ml DMSO-d6 5-phenyl-1H-tetrazole 
Assign. Shift(ppm)
A 8.084 B 7.65 C 7.63 CONFIRMED BY LAOCN PROGRAM.
Hz ppm Int.3238.68 8.104 48 3237.76 8.102 81 3235.93 8.097 600 3233.80 8.092 294 3233.18 8.091 328 3232.42 8.089 279 3231.51 8.086 276 3231.05 8.085 287 3230.44 8.084 246 3229.68 8.082 191 3228.00 8.078 625 3226.17 8.073 604 3222.96 8.065 62 3064.88 7.669 72 3064.27 7.668 60 3063.05 7.665 59 3060.46 7.658 180 3058.78 7.654 137 3056.03 7.647 461 3055.57 7.646 537 3054.96 7.645 382 3054.35 7.643 326 3053.89 7.642 358 3052.83 7.639 389 3050.08 7.632 925 3048.40 7.628 1000 3046.11 7.622 186 3045.20 7.620 202 3043.67 7.616 116 3039.25 7.605 37 3037.41 7.601 33
in DMSO-d6
KBr disc
nujol mull
