Molecular FormulaC8H11NO
Molecular Weight137.18
InChIInChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2
InChIKey DZGWFCGJZKJUFP-UHFFFAOYSA-N
SmilesC1(O)=CC=C(CCN)C=C1
Mass
MS-NW-4732 p-(2-aminoethyl)phenol C8H11NO (Mass of molecular ion: 137)
Source Temperature: 200 °C Sample Temperature: 180 °C Reservoir, 75 eV
18.0 3.7 27.0 2.2 28.0 5.4 30.0 100.0 31.0 1.7 32.0 1.2 39.0 3.5 42.0 1.0 50.0 1.5 51.0 3.4 52.0 2.1 53.0 2.4 55.0 1.2 63.0 1.5 65.0 1.7 77.0 8.9 78.0 2.8 79.0 2.2 80.0 1.1 90.0 1.1 91.0 2.6 106.0 1.1 107.0 26.3 108.0 47.6 109.0 3.9 120.0 1.3 137.0 8.2
400 MHz in DMSO-d6
1H NMR | 399.65 MHz |
C8 H11 N O | 0.046 g : 0.5 ml DMSO-d6 |
p-(2-aminoethyl)phenol |
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Assign. Shift(ppm) |
Hz ppm Int.
2797.49 7.000 31 2796.51 6.998 36 2793.46 6.990 108 2790.65 6.983 727 2788.70 6.978 319 2786.13 6.972 92 2784.18 6.967 280 2782.10 6.962 868 2779.42 6.955 126 2680.18 6.707 40 2677.25 6.699 139 2674.44 6.692 1000 2672.49 6.688 374 2669.80 6.681 90 2669.56 6.680 90 2668.09 6.677 292 2666.02 6.671 900 2663.21 6.664 112 1652.71 4.136 122 1087.89 2.723 360 1081.18 2.706 772 1079.96 2.703 463 1073.36 2.686 540 1017.82 2.547 470 1010.25 2.528 627 1006.47 2.519 118 1003.42 2.511 592
KBr disc
nujol mull
Tyramine(51-67-2) MS Atlas of Related Products
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