Product Name5,7-Diiodo-8-quinolinol
CAS83-73-8
Molecular FormulaC9H5I2NO
Molecular Weight396.95
InChIInChI=1S/C9H5I2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H
InChIKey UXZFQZANDVDGMM-UHFFFAOYSA-N
SmilesN1C2C(=C(I)C=C(I)C=2O)C=CC=1
Mass
MS-NW-7018 5,7-diiodo-8-quinolinol C9H5I2NO (Mass of molecular ion: 397)
Source Temperature: 190 °C Sample Temperature: 110 °C Direct, 75 eV
18.0 2.4 28.0 1.3 37.0 1.4 38.0 1.6 39.0 2.2 50.0 1.9 51.0 1.3 53.0 1.0 57.5 4.7 61.0 3.6 62.0 8.5 63.0 4.8 64.0 1.9 65.0 1.1 74.0 1.8 75.0 1.5 76.0 1.4 85.0 1.4 86.0 3.3 87.0 6.6 88.0 10.5 89.0 2.6 114.0 7.4 115.0 28.5 116.0 4.0 120.5 1.0 121.0 4.7 127.0 3.7 128.0 2.4 135.0 1.8 143.0 9.9 144.0 1.3 184.5 2.4 198.5 3.5 241.0 1.8 242.0 20.4 243.0 2.2 269.0 1.1 270.0 9.5 271.0 3.7 305.0 2.0 369.0 3.1 397.0 100.0 398.0 10.5
400 MHz in DMSO-d6 at 60C
1H NMR | 399.65 MHz |
C9 H5 I2 N O | 0.030 g : 0.5 ml DMSO-d6 at 60 C |
5,7-diiodo-8-quinolinol |
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Assign. Shift(ppm) |
Hz ppm Int.
3547.97 8.878 228 3546.51 8.875 279 3543.82 8.868 267 3542.36 8.864 280 3330.44 8.334 1000 3317.75 8.302 248 3316.16 8.298 292 3309.20 8.281 282 3307.62 8.277 310 3090.45 7.733 278 3086.18 7.723 287 3081.91 7.712 268 3077.64 7.701 273
DMSO-d6
KBr disc
nujol mull
5,7-Diiodo-8-quinolinol(83-73-8) 1H NMR Atlas of Related Products
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