| SpectraBase Spectrum ID |
2kdg8f5WojY |
| Name |
Metoprolol 2AC |
| Classification |
Pharmaceutical drug derivative |
| Comments |
Spectrum verified by crosschecking against external libraries (one 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 |
351.204573033 u |
| Formula |
C19H29NO5 |
| InChI |
InChI=1S/C19H29NO5/c1-14(2)20(15(3)21)12-19(25-16(4)22)13-24-18-8-6-17(7-9-18)10-11-23-5/h6-9,14,19H,10-13H2,1-5H3 |
| InChIKey |
PTOCIDOUTZOYRJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
351.443 g/mol |
| Nominal Mass |
351 u |
| Quality |
931 |
| Retention Index |
2578 |
| SMILES |
C(N(C(=O)C)C(C)C)C(COC=1C=CC(=CC1)CCOC)OC(=O)C |
| SPLASH |
splash10-0udi-6590000000-68b215f166ce9610c66c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(acetyl(propan-2-yl)amino)-3-(4-(2-methoxyethyl)phenoxy)propan-2-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_029773 |
