AZELANITRILE(1675-69-0) IR1
Product NameAZELANITRILE
CAS1675-69-0
Molecular FormulaC9H14N2
Molecular Weight150.22
InChIInChI=1S/C9H14N2/c10-8-6-4-2-1-3-5-7-9-11/h1-7H2
InChIKey QXOYPGTWWXJFDI-UHFFFAOYSA-N
SmilesC(#N)CCCCCCCC#N
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MassMS-IW-7343 azelanitrile C9H14N2 (Mass of molecular ion: 150)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 1.3 18.0 1.3 26.0 1.8 27.0 15.6 28.0 10.0 29.0 13.8 30.0 4.6 38.0 1.3 39.0 19.4 40.0 4.5 41.0 79.8 42.0 15.0 43.0 8.5 44.0 2.1 51.0 2.2 52.0 3.4 53.0 8.2 54.0 41.3 55.0 65.5 56.0 5.5 57.0 1.3 65.0 1.7 66.0 2.5 67.0 12.9 68.0 15.7 69.0 59.4 70.0 3.7 77.0 2.2 79.0 3.0 80.0 3.1 81.0 7.5 82.0 100.0 83.0 90.6 84.0 5.5 91.0 1.8 93.0 10.4 94.0 4.9 95.0 2.4 96.0 24.2 97.0 5.4 107.0 1.3 108.0 1.7 110.0 51.8 111.0 4.2 121.0 3.3 122.0 2.6 149.0 1.5 151.0 2.7
400 MHz in CDCl3
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1H NMR 399.65 MHz C9 H14 N2 0.05 ml : 0.5 ml CDCl3 azelanitrile 
Assign. Shift(ppm)
A 2.361 B 1.668 C 1.477 D 1.383
Hz ppm Int.950.68 2.379 550 948.12 2.373 45 943.60 2.362 1000 936.52 2.344 569 681.88 1.707 76 675.05 1.690 205 667.11 1.670 264 659.79 1.651 257 652.59 1.633 115 605.83 1.516 84 598.51 1.498 170 596.31 1.493 131 591.43 1.480 225 590.45 1.478 205 585.57 1.466 125 583.01 1.459 197 575.93 1.442 106 566.89 1.419 31 563.60 1.411 94 559.94 1.402 80 556.88 1.394 111 556.03 1.392 94 549.56 1.376 100 546.14 1.367 44 545.17 1.365 45 543.58 1.361 46 541.02 1.354 54
in CDCl3
liquid film
