Xylitol(87-99-0) 1H NMR
Molecular FormulaC5H12O5
Molecular Weight152.15
InChIInChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4+,5+
InChIKey HEBKCHPVOIAQTA-SCDXWVJYSA-N
SmilesOC[C@@H]([C@H]([C@@H](CO)O)O)O
-
MassMS-NW-1778 xylitol C5H12O5 (Mass of molecular ion: 152)
Source Temperature: 220 °C Sample Temperature: 170 °C Direct, 75 eV
14.0 1.5 15.0 23.3 18.0 3.7 19.0 22.8 26.0 1.5 27.0 10.6 28.0 17.1 29.0 17.5 30.0 2.8 31.0 32.5 32.0 1.5 39.0 2.0 41.0 2.2 42.0 7.8 43.0 53.5 44.0 51.5 45.0 31.6 46.0 1.7 47.0 1.7 55.0 10.0 56.0 32.2 57.0 13.1 59.0 1.0 60.0 12.0 61.0 100.0 62.0 4.6 71.0 2.6 72.0 2.5 73.0 36.3 74.0 48.1 75.0 2.4 85.0 6.7 91.0 35.2 92.0 1.2 103.0 24.5 104.0 1.6 121.0 1.3
in D2O
KBr disc
nujol mull
4880 A,200 M,powder
