SpectraBase Spectrum ID |
2nQYaHXSu0G |
Name |
Metoprolol-M 2ME |
Classification |
Pharmaceutical drug metabolite |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
254.151809184 u |
Formula |
C14H22O4 |
InChI |
InChI=1S/C14H22O4/c1-15-9-8-12-4-6-13(7-5-12)18-11-14(17-3)10-16-2/h4-7,14H,8-11H2,1-3H3 |
InChIKey |
WWODKLMRXWRURV-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
254.326 g/mol |
Nominal Mass |
254 u |
Quality |
904 |
Retention Index |
1821 |
SMILES |
C=1(C=CC(=CC1)CCOC)OCC(COC)OC |
SPLASH |
splash10-0a4i-3960000000-10c67acb4070fafdd11d |
Sample Comments |
Structure uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(2,3-dimethoxypropoxy)-4-(2-methoxyethyl)benzene |
Technique |
GC/MS |
Wiley ID |
DD2024_002450 |