(S)-(-)-1-(P-TOLYL)ETHYLAMINE(27298-98-2) MS
Product Name(S)-(-)-1-(P-TOLYL)ETHYLAMINE
CAS27298-98-2
Molecular FormulaC9H13N
Molecular Weight135.21
InChIInChI=1/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3/t8-/s3
InChIKey UZDDXUMOXKDXNE-SBYBRXNCNA-N
SmilesC1(=CC=C(C)C=C1)[C@@H](N)C |&1:7,r|
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MassMS-IW-4068 (S)-(-)-1-(p-tolyl)ethylamine C9H13N (Mass of molecular ion: 135)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
28.0 5.5 39.0 2.7 41.0 1.5 42.0 9.2 43.0 5.4 44.0 9.3 51.0 2.1 58.5 1.5 59.5 5.9 60.0 3.3 63.0 1.7 65.0 5.1 66.5 1.8 77.0 9.1 78.0 1.7 79.0 1.0 89.0 1.6 91.0 16.9 92.0 3.0 93.0 25.4 94.0 2.0 103.0 1.1 115.0 2.0 117.0 3.3 118.0 4.9 119.0 5.2 120.0 100.0 121.0 9.5 134.0 6.1 135.0 3.2
400 MHz in CDCl3
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1H NMR 399.65 MHz C9 H13 N 0.05 ml : 0.5 ml CDCl3 (S)-(-)-1-(p-tolyl)ethylamine 
Assign. Shift(ppm)
A 7.202 B 7.108 C 4.033 D 2.303 E 1.51 F 1.336
Hz ppm Int.2883.54 7.216 151 2882.20 7.212 321 2874.15 7.192 462 2844.24 7.117 393 2836.30 7.097 277 1622.19 4.060 53 1615.60 4.043 152 1608.89 4.026 154 1602.29 4.010 57 920.53 2.304 1000 604.98 1.514 188 540.28 1.352 78 537.48 1.345 921 533.69 1.336 75 530.76 1.329 904 522.22 1.307 21
in CDCl3
liquid film
