Product NameVinyl crotonate
CAS14861-06-4
Molecular FormulaC6H8O2
Molecular Weight112.13
InChIInChI=1S/C6H8O2/c1-3-5-6(7)8-4-2/h3-5H,2H2,1H3
InChIKey IYNRVIKPUTZSOR-UHFFFAOYSA-N
SmilesC(OC=C)(=O)C=CC

Mass
MS-NW-1347 vinyl trans-crotonate C6H8O2 (Mass of molecular ion: 112)
Source Temperature: 260 °C Sample Temperature: 180 °C Reservoir, 75 eV
15.0 4.2
18.0 1.1
26.0 1.8
27.0 4.3
28.0 2.2
37.0 1.0
38.0 2.5
39.0 23.6
40.0 3.2
41.0 53.5
42.0 2.2
43.0 1.4
68.0 1.5
69.0 100.0
70.0 4.5
112.0 2.1
90 MHz in CDCl3

| 1H NMR | 89.56 MHz |
| C6 H8 O2 | 0.04 ml : 0.5 ml CDCl3 |
| vinyl trans-crotonate | |
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Assign. Shift(ppm) |
Hz ppm Int.
668.00 7.459 351
661.69 7.389 383
655.31 7.317 67
654.06 7.304 392
652.19 7.283 114
648.31 7.239 250
647.75 7.233 420
641.44 7.163 205
639.75 7.144 85
634.63 7.087 68
632.81 7.066 262
625.94 6.990 265
619.06 6.913 86
536.19 5.987 84
534.50 5.969 278
532.81 5.950 283
531.19 5.932 94
520.69 5.814 65
519.00 5.795 220
517.31 5.777 226
515.63 5.758 72
447.06 4.992 389
445.56 4.975 407
433.06 4.836 327
431.56 4.819 382
413.75 4.620 382
412.25 4.604 371
407.44 4.550 382
405.94 4.533 340
176.44 1.971 990
174.75 1.952 1000
171.19 1.912 37
169.56 1.894 957
167.88 1.875 985
in CDCl3

liquid film

4880 A,200 M,liquid

Vinyl crotonate(14861-06-4) IR1 Atlas of Related Products
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