Product NameTRANS-2-HYDROXYCYCLOHEXYLP-TOLUENESULFONATE
CAS15051-90-8
Molecular FormulaC13H18O4S
Molecular Weight270.34
InChI
InChIKey
Smiles
Mass
MS-NW-7910 trans-2-hydroxycyclohexyl p-toluenesulfonate C13H18O4S (Mass of molecular ion: 270)
Source Temperature: 180 °C Sample Temperature: 140 °C Direct, 75 eV
17.0 1.3 18.0 5.4 19.0 1.3 27.0 9.2 28.0 2.1 29.0 6.6 31.0 5.0 39.0 13.3 40.0 2.0 41.0 34.0 42.0 6.2 43.0 6.5 44.0 2.3 45.0 1.2 47.0 1.7 50.0 1.7 51.0 3.8 52.0 1.6 53.0 3.6 54.0 4.4 55.0 7.9 56.0 2.0 57.0 11.9 62.0 1.1 63.0 4.9 64.0 1.7 65.0 23.0 66.0 1.7 67.0 13.1 68.0 2.2 69.0 34.6 70.0 31.7 71.0 2.9 77.0 5.4 78.0 1.4 79.0 35.5 80.0 6.7 81.0 3.9 83.0 11.1 87.0 1.1 89.0 5.6 90.0 3.8 91.0 63.6 92.0 45.7 93.0 5.4 97.0 82.1 98.0 100.0 99.0 7.4 107.0 8.7 108.0 7.8 115.0 43.6 116.0 3.0 121.0 1.2 139.0 5.7 155.0 8.8 156.0 6.6 157.0 7.6 171.0 1.0 172.0 8.7 173.0 7.5 174.0 1.1 269.0 1.5
400 MHz in CDCl3
1H NMR | 399.65 MHz |
C13 H18 O4 S | 0.042 g : 0.5 ml CDCl3 |
trans-2-hydroxycyclohexyl p-toluenesulfonate |
Assign. Shift(ppm) |
Hz ppm Int.
3134.28 7.843 53 3132.32 7.838 336 3130.74 7.834 149 3125.73 7.822 115 3123.78 7.817 373 2943.73 7.366 45 2941.77 7.361 235 2941.04 7.360 297 2940.43 7.358 235 2939.09 7.355 124 2935.18 7.345 80 2933.11 7.340 269 2932.50 7.338 271 1727.54 4.323 53 1722.66 4.311 57 1718.99 4.302 61 1716.55 4.296 65 1714.23 4.290 68 1711.67 4.283 62 1708.01 4.274 61 1703.13 4.262 58 1440.19 3.604 40 1435.67 3.593 59 1431.52 3.582 49 1430.05 3.579 56 1427.12 3.571 63 1425.17 3.567 63 1421.51 3.557 42 1416.63 3.545 47 1045.65 2.617 119 977.29 2.446 1000
in CDCl3
KBr disc
nujol mull
TRANS-2-HYDROXYCYCLOHEXYLP-TOLUENESULFONATE(15051-90-8) IR1 Atlas of Related Products
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