| SpectraBase Spectrum ID |
8JTQKRJrm4W |
| Name |
Guaifenesin |
| CAS Registry Number |
93-14-1 |
| Classification |
Pharmaceutical drug, expectorant |
| Comments |
Spectrum verified by crosschecking against external libraries (five reference spectrum with similarity >= 99% found); 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 |
1000 |
| Retention Index |
1420 |
| SMILES |
OCC(COC=1C(=CC=CC1)OC)O |
| SPLASH |
splash10-05fr-4900000000-e924077d6fa67289970f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Metfenossidiolo
Methphenoxydiol
3-(2-methoxyphenoxy)-1,2-propandiol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021716 |
