3-Indoxyl-beta-D-glucopyranoside(487-60-5) IR1
Product Name3-Indoxyl-beta-D-glucopyranoside
CAS487-60-5
Molecular FormulaC14H17NO6
Molecular Weight295.29
InChIInChI=1/C14H17NO6/c16-6-10-11(17)12(18)13(19)14(21-10)20-9-5-15-8-4-2-1-3-7(8)9/h1-5,10-19H,6H2/t10-,11-,12+,13-,14-/s3
InChIKey XVARCVCWNFACQC-JOAVLQHANA-N
SmilesC12C=CC=CC=1NC=C2O[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O |&1:10,11,13,14,16,r|
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MassMS-IW-8633 3-indolyl beta-D-glucopyranoside C14H17NO6 3H2O (Mass of molecular ion: 295)
Source Temperature: 230 °C Sample Temperature: 200 °C Direct, 75 eV
18.0 3.1 27.0 1.2 28.0 3.9 29.0 2.2 31.0 2.2 39.0 1.3 41.0 1.1 42.0 1.1 43.0 2.9 44.0 1.1 45.0 1.7 50.0 2.1 51.0 2.3 52.0 1.2 55.0 1.5 56.0 1.2 57.0 3.7 60.0 4.8 61.0 2.2 69.0 1.7 71.0 1.3 73.0 4.5 74.0 1.5 75.0 1.0 76.0 2.9 77.0 5.6 78.0 5.8 85.0 2.0 89.0 1.2 97.0 1.0 103.0 1.7 104.0 12.3 105.0 7.3 117.0 2.0 131.0 1.6 132.0 5.7 133.0 100.0 134.0 10.5 146.0 1.2
KBr disc
nujol mull
