SpectraBase Spectrum ID |
JIkFEhIctlo |
Name |
Guaifenesin |
CAS Registry Number |
93-14-1 |
Classification |
Pharmaceutical drug, expectorant |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
198.089208927 u |
Formula |
C10H14O4 |
InChI |
InChI=1S/C10H14O4/c1-13-9-4-2-3-5-10(9)14-7-8(12)6-11/h2-5,8,11-12H,6-7H2,1H3 |
InChIKey |
HSRJKNPTNIJEKV-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
198.218 g/mol |
Nominal Mass |
198 u |
Quality |
993 |
Retention Index |
1420 |
SMILES |
OCC(COC=1C(=CC=CC1)OC)O |
SPLASH |
splash10-05fr-3900000000-2f854150de134dad4188 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Metfenossidiolo
Methphenoxydiol
3-(2-methoxyphenoxy)-1,2-propandiol |
Technique |
GC/MS |
Wiley ID |
DD2024_001581 |