Product Name1,4-Diiodobutane
CAS628-21-7
Molecular FormulaC4H8I2
Molecular Weight309.92
InChIInChI=1S/C4H8I2/c5-3-1-2-4-6/h1-4H2
InChIKey ROUYUBHVBIKMQO-UHFFFAOYSA-N
SmilesC(I)CCCI

Mass
MS-IW-9182 1,4-diiodobutane C4H8I2 (Mass of molecular ion: 310)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
26.0 2.4
27.0 28.4
28.0 6.4
29.0 18.5
39.0 9.4
41.0 7.5
50.0 1.0
51.0 1.1
53.0 4.0
54.0 2.2
55.0 85.3
56.0 8.9
127.0 8.0
128.0 6.6
141.0 3.9
154.0 1.4
155.0 15.4
183.0 100.0
184.0 4.4
254.0 1.8
310.0 1.4
400 MHz in CDCl3

| 1H NMR | 399.65 MHz |
| C4 H8 I2 | 0.05 ml : 0.5 ml CDCl3 |
| 1,4-diiodobutane | |
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Assign. Shift(ppm) |
Hz ppm Int.
1288.94 3.226 448
1287.72 3.223 341
1286.38 3.219 307
1284.91 3.216 408
1283.45 3.212 446
1282.35 3.209 939
1281.13 3.206 444
1279.91 3.203 391
1278.32 3.199 290
1276.98 3.196 315
1275.76 3.193 430
786.25 1.968 427
785.03 1.965 282
783.33 1.961 401
782.47 1.958 468
779.66 1.951 1000
776.86 1.944 436
776.00 1.942 393
774.29 1.938 254
773.07 1.935 386
in CDCl3

liquid film


1,4-Diiodobutane(628-21-7) 1H NMR Atlas of Related Products
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