SpectraBase Spectrum ID |
JEhFybSczVQ |
Name |
Atenolol-A (-H2O) AC |
Classification |
Pharmaceutical drug, beta-adrenergic blocker |
Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
290.163042573 u |
Formula |
C16H22N2O3 |
InChI |
InChI=1S/C16H22N2O3/c1-12(2)18(13(3)19)9-4-10-21-15-7-5-14(6-8-15)11-16(17)20/h4-9,12H,10-11H2,1-3H3,(H2,17,20)/b9-4+ |
InChIKey |
VFUXAATYFWBOMB-RUDMXATFSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
290.363 g/mol |
Nominal Mass |
290 u |
Quality |
914 |
Retention Index |
2219 |
SMILES |
NC(CC1=CC=C(C=C1)OC\C=C\N(C(=O)C)C(C)C)=O |
SPLASH |
splash10-0a4v-4930000000-820506eeb791c8d879a7 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(4-(((2E)-3-(acetyl(propan-2-yl)amino)prop-2-en-1-yl)oxy)phenyl)acetamide |
Technique |
GC/MS |
Wiley ID |
DD2024_006225 |