(4S,5S)-(-)-2-甲基-5-苯基-2-噁唑啉-4-甲醇
产品名称 (4S,5S)-(-)-2-甲基-5-苯基-2-噁唑啉-4-甲醇
CAS号53732-41-5
分子式C11H13NO2
分子量191.23
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MassMS-NW-6692 (4S,5S)-(-)-2-methyl-5-phenyl-2-oxazoline-4-methanol C11H13NO2 (Mass of molecular ion: 191)
Source Temperature: 170 °C Sample Temperature: 120 °C Direct, 75 eV
15.0 3.7 18.0 1.9 27.0 2.0 28.0 3.0 29.0 1.8 30.0 3.2 31.0 2.1 39.0 2.4 41.0 1.0 42.0 8.2 43.0 83.5 44.0 4.6 50.0 1.6 51.0 5.4 52.0 1.4 53.0 1.0 57.0 2.4 59.0 1.7 60.0 63.5 61.0 1.8 63.0 1.3 65.0 1.6 68.0 6.6 77.0 13.1 78.0 2.6 79.0 11.6 84.0 1.9 85.0 100.0 86.0 7.4 89.0 1.5 90.0 1.3 91.0 10.3 92.0 1.0 102.0 10.5 103.0 5.6 104.0 1.0 105.0 3.4 107.0 8.0 117.0 1.4 118.0 7.6 119.0 8.1 120.0 1.3 132.0 1.4 136.0 5.8 160.0 5.6 161.0 1.3 178.0 1.1 191.0 1.1
400 MHz in CDCl3
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1H NMR 399.65 MHz C11 H13 N O2 0.037 g : 0.5 ml CDCl3 (4S,5S)-(-)-2-methyl-5-phenyl-2-oxazoline-4-methanol 
Assign. Shift(ppm)
A 7.37 B 7.31 C 7.28 D 5.336 E 4.67 F 3.996 G *1 3.878 J *1 3.633 K 2.073 J(G,J)=11.8HZ. J(G,F)=3.7HZ. J(J,F)=4.0HZ. J(D,F)=7.6HZ.
Hz ppm Int.2954.71 7.394 69 2952.88 7.389 113 2951.29 7.385 61 2948.24 7.378 82 2946.04 7.372 291 2944.46 7.368 188 2940.19 7.357 150 2938.84 7.354 357 2938.11 7.352 288 2936.52 7.348 146 2933.96 7.342 122 2932.25 7.338 216 2930.66 7.334 205 2929.20 7.330 163 2927.98 7.327 176 2925.29 7.320 207 2921.75 7.311 110 2920.65 7.309 110 2919.43 7.305 75 2917.97 7.302 83 2916.38 7.298 65 2912.48 7.288 322 2910.77 7.284 337 2908.57 7.278 102 2905.64 7.271 177 2136.60 5.347 213 2128.91 5.327 216 1604.86 4.016 36 1603.52 4.013 46 1601.07 4.007 66 1599.73 4.003 68 1598.63 4.001 57 1597.29 3.997 69 1595.95 3.994 69 1593.51 3.988 64 1592.16 3.984 63 1589.72 3.978 41 1588.38 3.975 35 1557.86 3.899 95 1554.32 3.890 81 1546.02 3.869 115 1542.48 3.860 96 1458.98 3.651 90 1454.96 3.641 85 1447.14 3.622 73 1443.12 3.611 65 829.22 2.075 1000 827.76 2.072 971
in CDCl3
KBr disc
nujol mull
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