6-Amino-m-cresol(2835-98-5) 13C NMR
Product Name6-Amino-m-cresol
CAS2835-98-5
Molecular FormulaC7H9NO
Molecular Weight123.15
InChIInChI=1S/C7H9NO/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,8H2,1H3
InChIKey HCPJEHJGFKWRFM-UHFFFAOYSA-N
SmilesC1(O)=CC(C)=CC=C1N
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MassMS-NW-7736 6-amino-m-cresol C7H9NO (Mass of molecular ion: 123)
Source Temperature: 150 °C Sample Temperature: 100 °C Direct, 75 eV
27.0 2.9 28.0 4.2 38.0 2.0 39.0 6.9 40.0 1.6 41.0 3.9 42.0 2.1 46.5 2.4 47.0 1.3 47.5 1.1 50.0 2.8 51.0 7.1 52.0 5.3 53.0 3.1 54.0 3.4 55.0 1.1 61.0 1.0 61.5 2.2 62.0 1.2 63.0 2.0 65.0 3.3 66.0 4.1 67.0 4.2 76.0 1.1 77.0 12.1 78.0 14.7 79.0 2.3 80.0 3.4 92.0 1.0 93.0 5.2 94.0 12.7 95.0 2.1 104.0 2.6 105.0 2.5 106.0 17.5 107.0 3.2 122.0 72.9 123.0 100.0 124.0 8.2
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C7 H9 N O 0.040 g : 0.5 ml DMSO-d6 6-amino-m-cresol 
Assign. Shift(ppm)
A 9. B 6.479 C 6.476 D 6.352 E 4.2 F 2.088 J(B,D)=2.0HZ J(B,F)=-0.6HZ J(C,D)=7.7HZ J(D,F)=-0.7HZ
Hz ppm Int.2592.65 6.488 264 2590.94 6.484 196 2590.33 6.482 196 2588.99 6.479 211 2584.96 6.469 322 2543.09 6.364 118 2542.48 6.362 123 2541.26 6.359 117 2540.53 6.357 103 2535.40 6.345 86 2534.67 6.343 93 2533.45 6.340 89 2532.71 6.338 81 834.72 2.089 1000
in DMSO-d6
KBr disc
nujol mull
