6-UNDECANOL(23708-56-7) 13C NMR
Product Name6-UNDECANOL
CAS23708-56-7
Molecular FormulaC11H24O
Molecular Weight172.31
InChIInChI=1S/C11H24O/c1-3-5-7-9-11(12)10-8-6-4-2/h11-12H,3-10H2,1-2H3
InChIKey YBIXBBGRHOUVBB-UHFFFAOYSA-N
SmilesCCCCCC(O)CCCCC
-
MassMS-NW-2587 6-undecanol C11H24O (Mass of molecular ion: 172)
Source Temperature: 260 °C Sample Temperature: 170 °C Reservoir, 75 eV
27.0 5.1 28.0 1.5 29.0 10.2 31.0 2.5 39.0 2.8 41.0 17.3 42.0 2.6 43.0 11.4 44.0 4.4 45.0 3.2 55.0 60.5 56.0 8.0 57.0 6.9 58.0 1.3 59.0 2.0 67.0 1.3 69.0 4.1 70.0 2.5 71.0 1.6 72.0 1.1 82.0 3.0 83.0 100.0 84.0 7.7 97.0 1.3 100.0 2.9 101.0 44.0 102.0 3.0 154.0 1.9
400 MHz in CDCl3
-
1H NMR 399.65 MHz C11 H24 O 0.05 ml : 0.5 ml CDCl3 6-undecanol 
Assign. Shift(ppm)
A 3.573 B 1.87 C 1.44 D 1.38 E 1.30 F 1.29 G 0.894
Hz ppm Int.1432.25 3.584 67 1430.79 3.581 58 1427.86 3.573 71 1424.93 3.566 68 1422.61 3.560 44 1422.36 3.560 44 1422.12 3.559 44 1421.75 3.558 44 1420.53 3.555 52 748.54 1.873 186 589.48 1.475 56 583.98 1.462 125 580.20 1.452 142 576.66 1.443 294 573.49 1.435 306 571.41 1.430 365 568.48 1.423 226 563.72 1.411 172 555.42 1.390 132 554.44 1.388 136 546.51 1.368 82 545.29 1.365 84 541.99 1.357 87 538.21 1.347 140 532.96 1.334 236 531.98 1.332 227 527.22 1.320 343 525.63 1.316 361 523.07 1.309 448 521.48 1.305 427 520.51 1.303 434 519.04 1.299 408 516.36 1.293 449 501.22 1.255 73 364.01 0.911 458 361.69 0.906 254 357.06 0.894 1000 350.10 0.877 481
in CDCl3
CCl4 solution
liquid film
