Molecular FormulaC6H14O6
Molecular Weight182.17
InChIInChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5+,6-
InChIKey FBPFZTCFMRRESA-GUCUJZIJSA-N
SmilesOC[C@@H]([C@H]([C@H]([C@@H](CO)O)O)O)O
Mass
MS-NW-1196 galactitol C6H14O6 (Mass of molecular ion: 182)
Source Temperature: 230 °C Sample Temperature: 180 °C Direct, 75 eV
14.0 1.0 15.0 12.9 17.0 1.0 18.0 4.9 19.0 14.5 26.0 1.1 27.0 7.5 28.0 7.2 29.0 13.6 30.0 2.5 31.0 26.2 32.0 1.1 39.0 2.4 41.0 5.9 42.0 7.0 43.0 34.5 44.0 20.2 45.0 23.4 46.0 1.4 47.0 1.6 55.0 8.5 56.0 26.0 57.0 19.6 58.0 1.4 59.0 1.5 60.0 13.1 61.0 58.8 62.0 2.2 69.0 4.1 71.0 10.4 72.0 1.7 73.0 100.0 74.0 45.2 75.0 3.1 85.0 7.9 86.0 1.3 87.0 1.2 91.0 8.9 97.0 1.7 103.0 21.4 104.0 1.9 115.0 2.9 133.0 14.1
400 MHz in D2O
1H NMR | 399.65 MHz |
C6 H14 O6 | 0.038 g : 0.5 ml D2O |
galactitol |
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Assign. Shift(ppm) |
Hz ppm Int.
1596.80 3.996 168 1593.63 3.988 36 1590.45 3.980 327 1583.98 3.964 206 1486.82 3.721 41 1481.57 3.708 1000 1475.22 3.692 700 1472.29 3.684 818
in D2O
in DMSO-d6
KBr disc
nujol mull
Dulcitol(608-66-2) IR2 Atlas of Related Products
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