5-Aminoindole(5192-03-0) MS
Product Name5-Aminoindole
CAS5192-03-0
Molecular FormulaC8H8N2
Molecular Weight132.16
InChIInChI=1S/C8H8N2/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H,9H2
InChIKey ZCBIFHNDZBSCEP-UHFFFAOYSA-N
SmilesN1C2=C(C=C(N)C=C2)C=C1
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MassMS2014-05014CW 5-aminoindole C8H8N2 (Mass of molecular ion: 132)
Source Temperature: 250 °C Sample Temperature: 200 °C Reservoir, 70 eV
28.0 1.9 50.0 1.8 51.0 3.7 52.0 3.5 53.0 1.5 63.0 1.3 65.0 1.6 66.0 6.0 75.0 1.2 76.0 2.9 77.0 7.3 78.0 6.2 79.0 3.1 80.0 1.8 102.0 1.3 103.0 1.7 104.0 24.9 105.0 13.6 106.0 1.6 115.0 1.3 129.0 1.1 131.0 33.3 132.0 100.0 133.0 9.2
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C8 H8 N2 0.039 g : 0.5 ml DMSO-d6 5-aminoindole 
Assign. Shift(ppm)
A 10.6 B 7.111 C 7.085 D 6.694 E 6.496 F 6.131 G 4.40
Hz ppm Int.4221.19 10.563 222 2844.70 7.118 430 2841.95 7.112 697 2839.20 7.105 444 2835.85 7.096 558 2831.73 7.086 42 2827.45 7.075 589 2676.39 6.697 641 2674.26 6.692 639 2601.47 6.510 438 2599.33 6.505 407 2592.93 6.489 412 2590.79 6.483 389 2453.31 6.139 327 2452.55 6.137 366 2450.56 6.132 560 2448.43 6.127 350 2447.66 6.125 298 1757.81 4.399 1000
in DMSO-d6
KBr disc
nujol mull
